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Pregn-16-ene-11,20-dione, 3-(acetyloxy)-
SpectraBase Compound ID 7bd5gbBVAdi
InChI InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(27-14(2)25)9-10-22(15,3)21(17)20(26)12-23(18,19)4/h7,15-17,19,21H,5-6,8-12H2,1-4H3
InChIKey JAZBMNIJZWDVQJ-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C23H32O4
Exact Mass 372.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqOuyz4k6vq
Name Pregn-16-ene-11,20-dione, 3-(acetyloxy)-
CAS Registry Number 56193-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O4
InChI InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(27-14(2)25)9-10-22(15,3)21(17)20(26)12-23(18,19)4/h7,15-17,19,21H,5-6,8-12H2,1-4H3
InChIKey JAZBMNIJZWDVQJ-UHFFFAOYSA-N
Molecular Weight 372.505 g/mol
SMILES CC12C(C3C(C4(C)C(CC(OC(C)=O)CC4)CC3)C(C1)=O)CC=C2C(C)=O
SPLASH splash10-0006-6912000000-ef813d72fac7c0803cdf
Source of Spectrum EP-1352-0-0
Synonyms 11,20-Dioxopregn-16-en-3-yl acetate (17-acetyl-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl) acetate (17-ethanoyl-10,13-dimethyl-11-oxidanylidene-1,2,3,4,5,6,7,8,9,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl) ethanoate Acetic acid (17-acetyl-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl) ester Acetic acid (17-acetyl-11-keto-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl) ester
Wiley ID 1355693