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17H-Cyclopenta[a]phenanthren-17-one, 11,12,13,16-tetrahydro-3-methoxy-13-methyl-, (S)-
SpectraBase Compound ID KXCHnzUCw5V
InChI InChI=1S/C19H18O2/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/h3-7,11H,8-10H2,1-2H3
InChIKey GSJXNXTTXUGDFZ-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C19H18O2
Exact Mass 278.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5F6dduYjQr7
Name 17H-Cyclopenta[a]phenanthren-17-one, 11,12,13,16-tetrahydro-3-methoxy-13-methyl-, (S)-
Alternate Name(s) 3-Methoxyestra-1,3,5(10),6,8,14-hexaen-17-one 3-Methoxy-13-methyl-12,16-dihydro-11H-cyclopenta[a]phenanthren-17-one
CAS Registry Number 56614-59-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O2
InChI InChI=1S/C19H18O2/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/h3-7,11H,8-10H2,1-2H3
InChIKey GSJXNXTTXUGDFZ-UHFFFAOYSA-N
Molecular Weight 278.351 g/mol
SMILES CC12CCc3c4ccc(cc4ccc3C2=CCC1=O)OC
SPLASH splash10-0fb9-1490000000-75d6168b5cd70877ed12
Source of Spectrum SD-1981-0-0
Wiley ID 40702