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1-Oxoandrost-2-en-17-yl acetate
SpectraBase Compound ID 3dh12pA5WLW
InChI InChI=1S/C21H30O3/c1-13(22)24-19-10-9-16-15-8-7-14-5-4-6-18(23)21(14,3)17(15)11-12-20(16,19)2/h4,6,14-17,19H,5,7-12H2,1-3H3/t14?,15-,16-,17-,19?,20-,21-/m0/s1
InChIKey RCAOANAZIVVAQE-FYHKVYPOSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37BGw9eIDiU
Name 1-Oxoandrost-2-en-17-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-13(22)24-19-10-9-16-15-8-7-14-5-4-6-18(23)21(14,3)17(15)11-12-20(16,19)2/h4,6,14-17,19H,5,7-12H2,1-3H3/t14?,15-,16-,17-,19?,20-,21-/m0/s1
InChIKey RCAOANAZIVVAQE-FYHKVYPOSA-N
Molecular Weight 330.468 g/mol
SMILES [C@@]12([C@]3(C(C=CCC3CC[C@]2([C@@]2(CCC([C@]2(CC1)C)OC(=O)C)[H])[H])=O)C)[H]
SPLASH splash10-052f-9611000000-bb2680e8f613fb08dc7b
Source of Spectrum CS-5-175-46
Synonyms Androst-2-en-17-ol-1-one acetate Acetic acid [(8S,9S,10S,13S,14S)-10,13-dimethyl-1-oxo-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] ester [(8S,9S,10S,13S,14S)-10,13-dimethyl-1-oxo-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate [(8S,9S,10S,13S,14S)-10,13-dimethyl-1-oxidanylidene-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] ethanoate
Wiley ID 49348