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9,11-ALPHA-EPOXY-ANDROSTA-1,4-DIEN-3,17-DIONE
SpectraBase Compound ID 3VsBOMF93mv
InChI InChI=1S/C19H22O3/c1-17-10-16-19(22-16)14(13(17)5-6-15(17)21)4-3-11-9-12(20)7-8-18(11,19)2/h7-9,13-14,16H,3-6,10H2,1-2H3/t13-,14-,16+,17-,18-,19-/m0/s1
InChIKey GCLIXCGWTLQNCF-FEJCRTRBSA-N
Mol Weight 298.38 g/mol
Molecular Formula C19H22O3
Exact Mass 298.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ur0RIxNCaW
Name Androsta-1,4-diene-3,17-dione, 9,11-epoxy-, (11.alpha.)-
CAS Registry Number 97549-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O3
InChI InChI=1S/C19H22O3/c1-17-10-16-19(22-16)14(13(17)5-6-15(17)21)4-3-11-9-12(20)7-8-18(11,19)2/h7-9,13-14,16H,3-6,10H2,1-2H3/t13-,14-,16+,17-,18-,19-/m0/s1
InChIKey GCLIXCGWTLQNCF-FEJCRTRBSA-N
Molecular Weight 298.382 g/mol
SMILES [C@@]123O[C@@]3(C[C@]3([C@]([C@@]1(CCC=1[C@@]2(C=CC(=O)C1)C)[H])(CCC3=O)[H])C)[H]
SPLASH splash10-0a4i-0090000000-94983e7c9d0be2f89fc8
Source of Spectrum I-63-1125-0
Synonyms (4aS,5aR,6aS,9aS,9bS)-4a,6a-dimethyl-6,6a,8,9,9a,9b,10,11-octahydrocyclopenta[7,8]phenanthro[4b,5-b]oxirene-2,7(4aH,5aH)-dione 9,11-Epoxy-9H-cyclopenta[a]phenanthrene, androsta-1,4-diene-3,17-dione deriv. 9,11.alpha.-epoxyandrosta-1,4-diene-3,17-dione
Wiley ID 1301261