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Gona-1,3,5(10)-trien-17-one, 1-methyl-
SpectraBase Compound ID 3ShMQTBCrQg
InChI InChI=1S/C18H22O/c1-11-3-2-4-12-5-6-14-13-9-10-17(19)15(13)7-8-16(14)18(11)12/h2-4,13-16H,5-10H2,1H3/t13-,14-,15-,16-/m0/s1
InChIKey WUZQWZJZRHDVIX-VGWMRTNUSA-N
Mol Weight 254.37 g/mol
Molecular Formula C18H22O
Exact Mass 254.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9iYYREbQXEE
Name Gona-1,3,5(10)-trien-17-one, 1-methyl-
CAS Registry Number 54212-45-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O
InChI InChI=1S/C18H22O/c1-11-3-2-4-12-5-6-14-13-9-10-17(19)15(13)7-8-16(14)18(11)12/h2-4,13-16H,5-10H2,1H3/t13-,14-,15-,16-/m0/s1
InChIKey WUZQWZJZRHDVIX-VGWMRTNUSA-N
Molecular Weight 254.373 g/mol
SMILES [C@@]12([C@]([C@@]3(CCC([C@]3(CC2)[H])=O)[H])(CCc2c1c(ccc2)C)[H])[H]
SPLASH splash10-0udi-0950000000-41d7e294087579908cca
Source of Spectrum KO-5-85-1
Synonyms 1-Methyl-oestra-1,3,5(10)-trien-18-nor-17-ketone 1-Methylgona-1,3,5(10)-trien-17-one
Wiley ID 1258379