Record Index Results
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Compound Name:
1-9
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1,861 Hit.
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Name
Formula / Structure
ExactMass
ID
1,10-Phenanthroline
5 spectra
C12H8N2
180.06875
0 TMS; BP:180; GC-TOF/MS
KZ000001
0 TMS; BP:180; GC-TOF/MS
KZ000093
BP:180; GC-TOF/MS
PR010090
LC-ESI-QTOF-MS/MS; CE:30 V; [M+H]+
PR100011
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100010
1,2-Dilauroyl-sn-Glycero-3-Phosphate
1 spectrum
C27H53O8P
536.34781
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M-H]-
PR100783
1,3-Diaminopropane
9 spectra
C3H10N2
74.08440
4 TMS; BP:174; GC-TOF/MS
KZ000002
4 TMS; BP:174; GC-TOF/MS
KZ000092
4 TMS; BP:73; GC-TOF/MS
PR010001
MS/MS; QqQ; CE:10 V; [M+H]+
KO002657
MS/MS; QqQ; CE:20 V; [M+H]+
KO002658
MS/MS; QqQ; CE:30 V; [M+H]+
KO002659
MS/MS; QqQ; CE:40 V; [M+H]+
KO002660
MS/MS; QqQ; CE:50 V; [M+H]+
KO002661
MS/MS; QqTOF; MERGED; [M+H]+
KOX00699
1,3-Dihydroxyacetone dimer
2 spectra
C6H12O6
180.06339
2 TMS; BP:73; GC-TOF/MS
PR010002
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M-H]-
PR100844
1,3-Dimethylurate
3 spectra
C7H8N4O3
196.05964
LC-ESI-QTOF-MS/MS; CE:30 V; [M-H]-
PR100869
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100413
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M-H]-
PR100868
1,3-Phenylenediamine
6 spectra
C6H8N2
108.06875
MS/MS; QqQ; CE:10 V; [M+H]+
KO003710
MS/MS; QqQ; CE:20 V; [M+H]+
KO003711
MS/MS; QqQ; CE:30 V; [M+H]+
KO003712
MS/MS; QqQ; CE:40 V; [M+H]+
KO003713
MS/MS; QqQ; CE:50 V; [M+H]+
KO003714
MS/MS; QqTOF; MERGED; [M+H]+
KOX00823
1,4-Butanediamine
7 spectra
C4H12N2
88.10005
4 TMS; BP:73; GC-TOF/MS
PR010101
MS/MS; QqQ; CE:10 V; [M+H]+
KO002423
MS/MS; QqQ; CE:20 V; [M+H]+
KO002424
MS/MS; QqQ; CE:30 V; [M+H]+
KO002425
MS/MS; QqQ; CE:40 V; [M+H]+
KO002426
MS/MS; QqQ; CE:50 V; [M+H]+
KO002427
MS/MS; QqTOF; MERGED; [M+H]+
KOX00669
1,4-Diaminobutane
1 spectrum
C4H12N2
88.10005
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100038
1,5-Diaminopentane
6 spectra
C5H14N2
102.11570
MS/MS; QqQ; CE:10 V; [M+H]+
KO002542
MS/MS; QqQ; CE:20 V; [M+H]+
KO002543
MS/MS; QqQ; CE:30 V; [M+H]+
KO002544
MS/MS; QqQ; CE:40 V; [M+H]+
KO002545
MS/MS; QqQ; CE:50 V; [M+H]+
KO002546
MS/MS; QqTOF; MERGED; [M+H]+
KOX00685
1,5-Diphenylcarbohydrazide
15 spectra
C13H14N4O
242.11676
(MS)3; IT; m/z: 243/150; [M+H]+
KO009102
(MS)3; IT; m/z: 243/226; [M+H]+
KO009101
MS/MS; IT; m/z: 243; [M+H]+
KO009100
MS/MS; QqQ; CE:10 V; [M+H]+
KO002791
MS/MS; QqQ; CE:10 V; [M-H]-
KO000689
MS/MS; QqQ; CE:20 V; [M+H]+
KO002792
MS/MS; QqQ; CE:20 V; [M-H]-
KO000690
MS/MS; QqQ; CE:30 V; [M+H]+
KO002793
MS/MS; QqQ; CE:30 V; [M-H]-
KO000691
MS/MS; QqQ; CE:40 V; [M+H]+
KO002794
MS/MS; QqQ; CE:40 V; [M-H]-
KO000692
MS/MS; QqQ; CE:50 V; [M+H]+
KO002795
MS/MS; QqQ; CE:50 V; [M-H]-
KO000693
MS/MS; QqTOF; MERGED; [M+H]+
KOX00221
MS/MS; QqTOF; MERGED; [M-H]-
KOX00220
1,5-anhydroglucitol
1 spectrum
C6H12O5
164.06847
MS/MS; IT; m/z: 163.2; [M-H]-
MT000011
1,6-Anhydro-beta-D-glucose
2 spectra
C6H10O5
162.05282
LC-ESI-QTOF-MS/MS; CE:30 V; [M-H]-
PR100859
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100325
1,7-Dimethylxanthine
2 spectra
C7H8N4O2
180.06473
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100414
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M-H]-
PR100870
1-Adamantanamine
6 spectra
C10H17N
151.13610
MS/MS; QqQ; CE:10 V; [M+H]+
KO002183
MS/MS; QqQ; CE:20 V; [M+H]+
KO002184
MS/MS; QqQ; CE:30 V; [M+H]+
KO002185
MS/MS; QqQ; CE:40 V; [M+H]+
KO002186
MS/MS; QqQ; CE:50 V; [M+H]+
KO002187
MS/MS; QqTOF; MERGED; [M+H]+
KOX00645
1-Amino-1-cyclopentanecarboxylate
12 spectra
C6H11NO2
129.07898
MS/MS; QqQ; CE:10 V; [M+H]+
KO002143
MS/MS; QqQ; CE:10 V; [M-H]-
KO000098
MS/MS; QqQ; CE:20 V; [M+H]+
KO002144
MS/MS; QqQ; CE:20 V; [M-H]-
KO000099
MS/MS; QqQ; CE:30 V; [M+H]+
KO002145
MS/MS; QqQ; CE:30 V; [M-H]-
KO000100
MS/MS; QqQ; CE:40 V; [M+H]+
KO002146
MS/MS; QqQ; CE:40 V; [M-H]-
KO000101
MS/MS; QqQ; CE:50 V; [M+H]+
KO002147
MS/MS; QqQ; CE:50 V; [M-H]-
KO000102
MS/MS; QqTOF; MERGED; [M+H]+
KOX00041
MS/MS; QqTOF; MERGED; [M-H]-
KOX00040
1-Amino-1-cyclopentanecarboxylic acid
3 spectra
C6H11NO2
129.07898
2 TMS; BP:73; GC-TOF/MS
PR010081
LC-ESI-QTOF-MS/MS; CE:30 V; [M+H]+
PR100002
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100001
1-Aminocyclopropane-1-carboxylate
3 spectra
C4H7NO2
101.04768
MS/MS; QqQ; CE:10 V; [M-H]-
KO000094
MS/MS; QqQ; CE:20 V; [M-H]-
KO000095
MS/MS; QqTOF; MERGED; [M-H]-
KOX00037
1-Aminocyclopropane-1-carboxylic acid
4 spectra
C4H7NO2
101.04768
2 TMS; BP:147; GC-TOF/MS
KZ000169
2 TMS; BP:73; GC-TOF/MS
PR010007
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR100012
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M-H]-
PR100488
1-Aminoethylphosphonate
6 spectra
C2H8NO3P
125.02418
MS/MS; QqQ; CE:10 V; [M-H]-
KO000113
MS/MS; QqQ; CE:20 V; [M-H]-
KO000114
MS/MS; QqQ; CE:30 V; [M-H]-
KO000115
MS/MS; QqQ; CE:40 V; [M-H]-
KO000116
MS/MS; QqQ; CE:50 V; [M-H]-
KO000117
MS/MS; QqTOF; MERGED; [M-H]-
KOX00046
1-Decanoyl-2-Hydroxy-sn-Glycero-3-Phosphocholine
1 spectrum
C18H39NO7P
412.24641
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M]+
PR100341
1-Isothiocyanato-6-(methylsulfinyl)-hexane
1 spectrum
C8H15NOS2
205.05951
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR101036
1-Isothiocyanato-6-(methylsulfonyl)-hexane
1 spectrum
C8H15NO2S2
221.05442
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR101039
1-Isothiocyanato-7-(methylsulfinyl)-heptane
1 spectrum
C9H17NOS2
219.07516
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR101035
1-Isothiocyanato-8-(methylsulfinyl)-octane
1 spectrum
C10H19NOS2
233.09081
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR101038
1-Isothiocyanato-9-(methylsulfinyl)-nonane
1 spectrum
C11H21NOS2
247.10646
LC-ESI-QTOF-MS/MS; CE:Ramp 5-60 V; [M+H]+
PR101037
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