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4.beta.-A-nor-Pregnane-3,20-dione
SpectraBase Compound ID 6219wZvPu8E
InChI InChI=1S/C20H30O2/c1-12(21)14-6-7-15-13-4-5-17-18(22)9-11-20(17,3)16(13)8-10-19(14,15)2/h13-17H,4-11H2,1-3H3/t13?,14?,15?,16?,17-,19-,20-/m1/s1
InChIKey JWBFWFRCDNATCY-QBHRZVHSSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoREbapbNtp
Name 4.beta.-A-nor-Pregnane-3,20-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-12(21)14-6-7-15-13-4-5-17-18(22)9-11-20(17,3)16(13)8-10-19(14,15)2/h13-17H,4-11H2,1-3H3/t13?,14?,15?,16?,17-,19-,20-/m1/s1
InChIKey JWBFWFRCDNATCY-QBHRZVHSSA-N
Molecular Weight 302.458 g/mol
SMILES [C@@]12(C3C(C4CCC([C@]4(CC3)C)C(=O)C)CC[C@@]2(C(=O)CC1)[H])C
SPLASH splash10-0f89-0094000000-ef5e392b363fcafee9e2
Source of Spectrum G-56-989-0
Synonyms (3aR,5aS,10aS)-6-acetyl-3a,5a-dimethyltetradecahydrodicyclopenta[a,f]naphthalen-1(2H)-one
Wiley ID 748350