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Estra-1,3,5,7,9-pentaen-17-one, 3-methoxy-
SpectraBase Compound ID ApZdHR8REpU
InChI InChI=1S/C19H20O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h3-6,11,17H,7-10H2,1-2H3
InChIKey LAFFTPKGTZPBMG-UHFFFAOYSA-N
Mol Weight 280.37 g/mol
Molecular Formula C19H20O2
Exact Mass 280.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nIVyNeWecj
Name Estra-1,3,5,7,9-pentaen-17-one, 3-methoxy-
CAS Registry Number 3907-67-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O2
InChI InChI=1S/C19H20O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h3-6,11,17H,7-10H2,1-2H3
InChIKey LAFFTPKGTZPBMG-UHFFFAOYSA-N
Molecular Weight 280.367 g/mol
SMILES CC12C(c3c(c4c(cc(OC)cc4)cc3)CC1)CCC2=O
SPLASH splash10-001i-2590000000-f56c389b6acd355405c5
Source of Spectrum C-84-4549-12
Synonyms 3-Methoxyestra-1(10),2,4,6,8-pentaen-17-one 3-Methoxy-13-methyl-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one dl-Equilenin methyl ether Equilenin 3-methyl ether Equilenin methyl ether O-Methylequilenin
Wiley ID 1284376