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18-Nor-16-oxaandrost-12-en-17-one, 4,4,8-trimethyl-, (5.alpha.)-(.+-.)-
SpectraBase Compound ID LaykVYc43Zu
InChI InChI=1S/C20H30O2/c1-18(2)9-5-10-20(4)15(18)8-11-19(3)14-12-22-17(21)13(14)6-7-16(19)20/h6,14-16H,5,7-12H2,1-4H3/t14-,15+,16+,19?,20+/m1/s1
InChIKey DCFIJMVSAFTYKV-QKGBRHBFSA-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 4XyRuJjfc5t
Name 18-Nor-16-oxaandrost-12-en-17-one, 4,4,8-trimethyl-, (5.alpha.)-(.+-.)-
Alternate Name(s) (+,-)-Isoagatholactone (.+-.)-Isoagatholactone (3aS,5aS,9aS,9bR)-3b,6,6,9a-tetramethyl-3a,3b,4,5,5a,6,7,8,9,9a,9b,10-dodecahydrophenanthro[1,2-c]furan-1(3H)-one Phenanthro[1,2-c]furan, 18-nor-16-oxaandrost-12-en-17-one deriv.
CAS Registry Number 82570-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-18(2)9-5-10-20(4)15(18)8-11-19(3)14-12-22-17(21)13(14)6-7-16(19)20/h6,14-16H,5,7-12H2,1-4H3/t14-,15+,16+,19?,20+/m1/s1
InChIKey DCFIJMVSAFTYKV-QKGBRHBFSA-N
Molecular Weight 302.458 g/mol
SMILES C12([C@@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)(CC=C2[C@]1(COC2=O)[H])[H])C
SPLASH splash10-002f-0900000000-de811955064ae011cfcf
Source of Spectrum KC-1983-138-0
Wiley ID 1305123