MassBank Record: FFF00211



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

ACCESSION: FFF00211
RECORD_TITLE: Dihydrotestosterone; LC-APPI-QQ; MS2; CE:20 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$NAME: Dihydrotestosterone CH$COMPOUND_CLASS: Natural Product; Steroid hormone CH$FORMULA: C19H30O2 CH$EXACT_MASS: 290.22458 CH$SMILES: O=C(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1 CH$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/h12,14-17,21H,3-11H2,1-2H3/t12-,14?,15?,16?,17-,18?,19?/m0/s1 CH$LINK: CAS 521-18-6 CH$LINK: LIPIDBANK SST0297 CH$LINK: INCHIKEY NVKAWKQGWWIWPM-FMFZMMAASA-N
AC$INSTRUMENT: API2000 AC$INSTRUMENT_TYPE: LC-APPI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: RETENTION_TIME 0.820850 min
MS$FOCUSED_ION: BASE_PEAK 291.200012 MS$FOCUSED_ION: PRECURSOR_M/Z 291.300000 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0006-0290000000-0ac4405543b101b460e8 PK$NUM_PEAK: 274 PK$PEAK: m/z int. rel.int. 43.299999 1350.500000 1 54.900002 1350.500000 1 55.500000 1350.500000 1 55.700001 1350.500000 1 57.200001 1350.500000 1 57.400002 1350.500000 1 67.149998 2701.000000 2 68.800003 1350.500000 1 70.199997 1350.500000 1 71.099998 2701.000000 2 72.599998 1350.500000 1 73.800003 1350.500000 1 74.000000 1350.500000 1 78.900002 1350.500000 1 79.800003 2701.000000 2 80.699997 4051.500000 3 81.160000 27010.000000 20 83.099998 1350.500000 1 83.350002 2701.000000 2 84.599998 1350.500000 1 84.900002 1350.500000 1 85.099998 4051.500000 3 89.800003 1350.500000 1 90.199997 1350.500000 1 90.599998 4051.500000 3 90.800003 4051.500000 3 91.000000 4051.500000 3 91.300003 6752.500000 5 92.199997 1350.500000 1 92.599998 2701.000000 2 92.800003 5402.000000 4 93.099998 9453.500000 7 93.316669 8103.000000 6 93.900002 2701.000000 2 94.816669 8103.000000 6 95.199998 6752.500000 5 96.199997 1350.500000 1 96.599998 1350.500000 1 96.900002 1350.500000 1 97.300003 1350.500000 1 98.000000 2701.000000 2 98.880002 13505.000000 10 99.337502 10804.000000 8 101.300003 4051.500000 3 104.450001 2701.000000 2 104.888237 22958.500000 17 106.500000 4051.500000 3 106.900002 21608.000000 16 107.219998 13505.000000 10 107.599998 1350.500000 1 108.599998 4051.500000 3 109.119998 13505.000000 10 109.400002 2701.000000 2 110.400002 1350.500000 1 111.300003 5402.000000 4 111.500000 2701.000000 2 116.599998 1350.500000 1 118.199997 1350.500000 1 118.699997 4051.500000 3 119.199997 12154.500000 9 120.400002 2701.000000 2 120.599998 1350.500000 1 121.099998 9453.500000 7 121.316669 8103.000000 6 122.599998 5402.000000 4 123.033333 8103.000000 6 123.400002 2701.000000 2 123.599998 1350.500000 1 124.800003 1350.500000 1 125.049999 2701.000000 2 127.099998 1350.500000 1 129.100006 2701.000000 2 129.300003 5402.000000 4 130.899994 1350.500000 1 131.100006 6752.500000 5 131.399994 2701.000000 2 131.600006 1350.500000 1 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