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7-HYDROXY-3-OXOANDROSTAN-17-YL ACETATE
SpectraBase Compound ID JmOVSJe56wn
InChI InChI=1S/C21H32O4/c1-12(22)25-18-5-4-15-19-16(7-9-21(15,18)3)20(2)8-6-14(23)10-13(20)11-17(19)24/h13,15-19,24H,4-11H2,1-3H3/t13?,15?,16?,17?,18?,19?,20-,21-/m0/s1
InChIKey QXJNGIOCIGKCIR-ACUUMRKFSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JR0P9vCzcPT
Name 7-HYDROXY-3-OXOANDROSTAN-17-YL ACETATE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 348.230059506 u
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-12(22)25-18-5-4-15-19-16(7-9-21(15,18)3)20(2)8-6-14(23)10-13(20)11-17(19)24/h13,15-19,24H,4-11H2,1-3H3/t13?,15?,16?,17?,18?,19?,20-,21-/m0/s1
InChIKey QXJNGIOCIGKCIR-ACUUMRKFSA-N
Molecular Weight 348.483 g/mol
Nominal Mass 348 u
Number of Peaks 273
SMILES OC1CC2CC(CC[C@@]2(C2CC[C@@]3(C(CCC3C12)OC(C)=O)C)C)=O
SPLASH splash10-052f-7931000000-4e559097b8d888de34d0
Source File Reference LMCM-34262-312A
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (2S,15S)-9-hydroxy-2,15-dimethyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate ACETIC ACID 7-HYDROXY-10,13-DIMETHYL-3-OXO-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL ESTER
Wiley ID 8_17696