MassBank Record: FFF00263



 Androstenedione; LC-APPI-QQ; MS2; CE:10 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: FFF00263
RECORD_TITLE: Androstenedione; LC-APPI-QQ; MS2; CE:10 V; [M+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$NAME: Androstenedione CH$COMPOUND_CLASS: Natural Product; Steroid hormone CH$FORMULA: C19H26O2 CH$EXACT_MASS: 286.19328 CH$SMILES: O=C(C4)C=C(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1 CH$IUPAC: InChI=1S/C19H26O2/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/h11,14-16H,3-10H2,1-2H3/t14?,15?,16?,18-,19-/m0/s1 CH$LINK: CAS 63-05-8 CH$LINK: LIPIDBANK SST0028 CH$LINK: INCHIKEY AEMFNILZOJDQLW-WFZCBACDSA-N CH$LINK: COMPTOX DTXSID40424100
AC$INSTRUMENT: API2000 AC$INSTRUMENT_TYPE: LC-APPI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: RETENTION_TIME 0.820850 min
MS$FOCUSED_ION: BASE_PEAK 287.200012 MS$FOCUSED_ION: PRECURSOR_M/Z 287.300000 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-000i-0090000000-d835662fe0064700eeb8 PK$NUM_PEAK: 225 PK$PEAK: m/z int. rel.int. 36.099998 1350.500000 1 71.099998 1350.500000 1 80.900002 2701.000000 1 81.800003 1350.500000 1 82.000000 1350.500000 1 82.199997 1350.500000 1 82.400002 2701.000000 1 82.955556 12154.500000 1 83.300003 6752.500000 1 91.300003 1350.500000 1 93.199997 1350.500000 1 93.699997 1350.500000 1 94.950001 2701.000000 1 95.400002 2701.000000 1 96.049999 16206.000000 1 97.073896 703610.500000 5 98.300003 1350.500000 1 104.800003 1350.500000 1 105.199997 5402.000000 1 105.800003 4051.500000 1 106.500000 2701.000000 1 107.000000 6752.500000 1 109.042581 418655.000000 3 110.599998 1350.500000 1 110.900002 1350.500000 1 111.400002 1350.500000 1 115.000000 1350.500000 1 118.599998 1350.500000 1 118.900002 2701.000000 1 120.199997 4051.500000 1 120.980000 13505.000000 1 121.400002 2701.000000 1 122.199997 1350.500000 1 123.099998 16206.000000 1 123.300003 17556.500000 1 130.000000 1350.500000 1 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