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3-beta-Hydroxy-5-alpha-androst-1-en-17-one
SpectraBase Compound ID 19Y9b5FpapH
InChI InChI=1S/C19H28O2/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/h7,9,12-16,20H,3-6,8,10-11H2,1-2H3/t12-,13-,14?,15?,16?,18-,19-/m0/s1
InChIKey DYMROBVXGSLPAY-FMLJXKFRSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HEcjuf6aeW
Name 3-beta-Hydroxy-5-alpha-androst-1-en-17-one
Classification Designer steroid
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 288.208930140 u
Formula C19H28O2
InChI InChI=1S/C19H28O2/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/h7,9,12-16,20H,3-6,8,10-11H2,1-2H3/t12-,13-,14?,15?,16?,18-,19-/m0/s1
InChIKey DYMROBVXGSLPAY-FMLJXKFRSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 288.431 g/mol
Nominal Mass 288 u
Quality 999
Retention Index 2498
SMILES O[C@@]1(C[C@]2([C@@](C3C(C4[C@@](C(CC4)=O)(CC3)C)CC2)(C=C1)C)[H])[H]
SPLASH splash10-07if-3950000000-37574e01e17f15763cee
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-DHEA (5aS,7R,9aR,11aS)-7-hydroxy-9a,11a-dimethyl-2,3,3a,3b,4,5,5a,6,7,9a,9b,10,11,11a-\rtetradecahydro-1H-cyclopenta[a]phenanthren-1-one
Technique GC/MS
Wiley ID DD2024_011521