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Estra-1,3,5(10),6-tetraen-17-one, 3-hydroxy-1,2-dimethyl-
SpectraBase Compound ID 2sS6RxcBuGY
InChI InChI=1S/C20H24O2/c1-11-12(2)19-13(10-17(11)21)4-5-14-15(19)8-9-20(3)16(14)6-7-18(20)22/h4-5,10,14-16,21H,6-9H2,1-3H3
InChIKey WLTAJCTYSYYMOI-UHFFFAOYSA-N
Mol Weight 296.41 g/mol
Molecular Formula C20H24O2
Exact Mass 296.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwJCyQmxu1C
Name Estra-1,3,5(10),6-tetraen-17-one, 3-hydroxy-1,2-dimethyl-
CAS Registry Number 1818-09-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O2
InChI InChI=1S/C20H24O2/c1-11-12(2)19-13(10-17(11)21)4-5-14-15(19)8-9-20(3)16(14)6-7-18(20)22/h4-5,10,14-16,21H,6-9H2,1-3H3
InChIKey WLTAJCTYSYYMOI-UHFFFAOYSA-N
Molecular Weight 296.410 g/mol
SMILES Oc1cc2C=CC3C(CCC4(C)C3CCC4=O)c2c(C)c1C
SPLASH splash10-0002-1970000000-1af3bb37609ac7aed70e
Source of Spectrum DE-0-53-0
Synonyms 3-Hydroxy-1,2-dimethylestra-1(10),2,4,6-tetraen-17-one 1,2,13-trimethyl-3-oxidanyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-17-one 3-Hydroxy-1,2,13-trimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-17-one
Wiley ID 43845