MassBank Record: FFF00249



 Androsterone; LC-APPI-QQ; MS2; CE:20 V; [M-H2O+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: FFF00249
RECORD_TITLE: Androsterone; LC-APPI-QQ; MS2; CE:20 V; [M-H2O+H]+
DATE: 2016.01.19 (2011.04.05, 2011.06.20)
AUTHORS: , Atsushi Yamamoto, PFOS.jp
LICENSE: CC BY-SA
COPYRIGHT: PFOS.jp
COMMENT: Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

CH$NAME: Androsterone CH$COMPOUND_CLASS: Natural Product; Steroid hormone CH$FORMULA: C19H30O2 CH$EXACT_MASS: 290.22458 CH$SMILES: OC(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1 CH$IUPAC: InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14?,15?,16?,18?,19?/m0/s1 CH$LINK: CAS 53-41-8 CH$LINK: LIPIDBANK SST0002 CH$LINK: INCHIKEY QGXBDMJGAMFCBF-LISVHTKMSA-N
AC$INSTRUMENT: API2000 AC$INSTRUMENT_TYPE: LC-APPI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: RETENTION_TIME 0.820833 min
MS$FOCUSED_ION: BASE_PEAK 255.199997 MS$FOCUSED_ION: PRECURSOR_M/Z 273.300000 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H2O+H]+
PK$SPLASH: splash10-0ab9-0590000000-ca4a529fd51ccc00f4a5 PK$NUM_PEAK: 263 PK$PEAK: m/z int. rel.int. 38.299999 1350.500000 1 40.400002 1350.500000 1 40.799999 1350.500000 1 41.099998 2701.000000 1 41.299999 1350.500000 1 42.700001 2701.000000 1 43.100000 8103.000000 1 43.400002 1350.500000 1 53.000000 4051.500000 1 53.200001 2701.000000 1 53.400002 1350.500000 1 54.400002 2701.000000 1 54.883334 8103.000000 1 55.163636 14855.500000 1 55.799999 1350.500000 1 56.000000 1350.500000 1 57.000000 1350.500000 1 57.200001 2701.000000 1 63.000000 2701.000000 1 64.599998 1350.500000 1 64.900002 1350.500000 1 65.099998 1350.500000 1 65.300003 2701.000000 1 65.699997 1350.500000 1 66.000000 1350.500000 1 66.199997 5402.000000 1 66.800003 14855.500000 1 67.099998 31061.500000 1 67.699997 1350.500000 1 68.199997 2701.000000 1 69.219998 13505.000000 1 70.500000 1350.500000 1 71.000000 6752.500000 1 71.266668 8103.000000 1 72.599998 1350.500000 1 75.699997 1350.500000 1 76.300003 1350.500000 1 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