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Name
Formula / Structure
ExactMass
ID
E-3,4,5'-Trihydroxy-3'-glucopyranosylstilbene
1 spectrum
C20H22O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
406.12637
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100927
E-64
16 spectra
C15H27N5O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
357.20123
LC-ESI-IT; MS2; m/z: 358; [M+H]+
MSBNK-Keio_Univ-KO008950
LC-ESI-IT; MS3; m/z: 358/114; [M+H]+
MSBNK-Keio_Univ-KO008955
LC-ESI-IT; MS3; m/z: 358/244; [M+H]+
MSBNK-Keio_Univ-KO008954
LC-ESI-IT; MS3; m/z: 358/298; [M+H]+
MSBNK-Keio_Univ-KO008953
LC-ESI-IT; MS3; m/z: 358/330; [M+H]+
MSBNK-Keio_Univ-KO008952
LC-ESI-IT; MS3; m/z: 358/341; [M+H]+
MSBNK-Keio_Univ-KO008951
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002844
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000724
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002845
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000725
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002846
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000726
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002847
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000727
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002848
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000728
E-Astringin, E-3,4,5'-trihydroxy-3'-glucopyranosyl...
8 spectra
C20H22O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
406.38699
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122902
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122903
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122908
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122909
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122910
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS122911
E-Astringin, E-3,4,5'-trihydroxy-3'-glucopyranosyl...
1 spectrum
C20H22O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
406.38699
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT112290
E-Isorhapontin, (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(...
1 spectrum
C21H24O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
420.41400
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT112300
E-Isorhapontin, E-4,5'-dihydroxy-3-methoxy-3'-gluc...
6 spectra
C21H24O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
420.41400
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS123001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS123002
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS123003
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS123007
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS123008
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS123009
E-Resveratrol trimethyl ether
13 spectra
C17H18O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
270.32800
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304276
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304277
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304278
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304279
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304280
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304281
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304282
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304283
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304284
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304285
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304286
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304287
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310416
Ebastin
7 spectra
C32H39NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
469.29807
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM849302
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU251201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU251202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU251203
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU251204
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU251205
LC-ESI-QTOF; MS2; CE: Ramp 25.0-37.5 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU251206
Eburicoic acid
14 spectra
C31H50O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
470.37601
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00317
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00318
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00319
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00320
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 50 V
MSBNK-MSSJ-MSJ00321
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00322
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00310
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00311
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00312
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00313
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 50 V
MSBNK-MSSJ-MSJ00314
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00315
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00316
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00309
Eburnamonine
2 spectra
C19H22N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
294.17322
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML81152
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML81150
Ecdysterone 22-O-benzoate
9 spectra
C34H48O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
584.75690
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01707
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04350
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01706
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04351
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01705
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04352
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01708
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04349
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000404
Ecgonine-methyl-ester (EME)
14 spectra
C10H17NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
199.12083
LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
MSBNK-Eawag-EQ361907
LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
MSBNK-Eawag-EQ361908
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ361901
LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
MSBNK-Eawag-EQ361909
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ361902
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ361903
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ361904
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ361905
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ361906
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161801
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161802
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161803
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161804
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161805
Ecgoninemethylester
6 spectra
C10H17NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
199.12083
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000515
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000514
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000513
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000512
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000511
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000510
Echimidine
20 spectra
C20H31NO7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
397.21011
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002464
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003607
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003608
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002465
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002466
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002467
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002468
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002859
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002860
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002861
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002862
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002863
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003239
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003240
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003241
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003242
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003243
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003604
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003605
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003606
Echimidine N-oxide
20 spectra
C20H31NO8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
413.20499
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002469
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003612
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003613
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002470
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002471
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002472
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002473
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002864
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002865
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002866
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002867
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002868
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003244
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003245
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003246
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003247
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003248
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003609
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003610
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003611
Echinatine
4 spectra
C15H25NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
299.37021
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00510
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00511
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00512
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00509
Echinenone
2 spectra
C40H54O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
550.41748
FAB-EBEB; MS2; m/z: 550.42; [M]*+
MSBNK-Kyoto_Univ-CA000149
LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; CE 30 V
MSBNK-MSSJ-MSJ00126
Echinocandin B
6 spectra
C52H81N7O16
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
1059.57397
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003287
LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003288
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003289
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003290
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003291
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003292
Echinocystic acid-3-O-glucoside
10 spectra
C36H58O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
634.85101
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305309
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305310
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305311
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305312
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305313
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305314
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305315
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305316
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305317
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308691
Echisoside
5 spectra
C21H30O14
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
506.46490
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01134
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01135
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01136
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01133
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000279
Econazole
6 spectra
C18H15Cl3N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
380.02499
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU064601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU064602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU064603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU064604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU064605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU064606
Ectoine
10 spectra
C6H10N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
142.07423
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002834
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000714
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002835
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000715
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002836
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000716
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002837
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000717
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002838
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000718
ectoine
2 spectra
C6H10N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
142.07420
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+
MSBNK-MetaboLights-ML003701
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-MetaboLights-ML003751
EDDP
24 spectra
C20H23N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
277.18301
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-Eawag-EA282508
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
MSBNK-Eawag-EA282502
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-Eawag-EA282509
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+
MSBNK-Eawag-EA282503
LC-ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-Eawag-EA282514
LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M+H]+
MSBNK-Eawag-EA282501
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-Eawag-EA282510
LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M+H]+
MSBNK-Eawag-EA282504
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-Eawag-EA282511
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
MSBNK-Eawag-EA282505
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-Eawag-EA282512
LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M+H]+
MSBNK-Eawag-EA282506
LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M+H]+
MSBNK-Eawag-EA282513
LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M+H]+
MSBNK-Eawag-EA282507
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA002264
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002265
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002266
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002267
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002268
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161501
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161502
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161503
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161504
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU161505
Edetic acid (EDTA)
16 spectra
C10H16N2O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
292.09070
LC-ESI-QFT; MS2; CE: 120%; R=15000; [M+H]+
MSBNK-Eawag-EQ500507
LC-ESI-QFT; MS2; CE: 120%; R=15000; [M-H]-
MSBNK-Eawag-EQ500557
LC-ESI-QFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-Eawag-EQ500501
LC-ESI-QFT; MS2; CE: 15%; R=15000; [M-H]-
MSBNK-Eawag-EQ500551
LC-ESI-QFT; MS2; CE: 150%; R=15000; [M+H]+
MSBNK-Eawag-EQ500508
LC-ESI-QFT; MS2; CE: 180%; R=15000; [M+H]+
MSBNK-Eawag-EQ500509
LC-ESI-QFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-Eawag-EQ500502
LC-ESI-QFT; MS2; CE: 30%; R=15000; [M-H]-
MSBNK-Eawag-EQ500552
LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-Eawag-EQ500503
LC-ESI-QFT; MS2; CE: 45%; R=15000; [M-H]-
MSBNK-Eawag-EQ500553
LC-ESI-QFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-Eawag-EQ500504
LC-ESI-QFT; MS2; CE: 60%; R=15000; [M-H]-
MSBNK-Eawag-EQ500554
LC-ESI-QFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-Eawag-EQ500505
LC-ESI-QFT; MS2; CE: 75%; R=15000; [M-H]-
MSBNK-Eawag-EQ500555
LC-ESI-QFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-Eawag-EQ500506
LC-ESI-QFT; MS2; CE: 90%; R=15000; [M-H]-
MSBNK-Eawag-EQ500556
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