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Estra-1,3,5(10),15-tetraen-17.beta.-ol, 3-methoxy-, acetate
SpectraBase Compound ID JdyWNq1t4yR
InChI InChI=1S/C21H26O3/c1-13(22)24-20-9-8-19-18-6-4-14-12-15(23-3)5-7-16(14)17(18)10-11-21(19,20)2/h5,7-9,12,17-20H,4,6,10-11H2,1-3H3
InChIKey IHCZGKUYOKUPDG-UHFFFAOYSA-N
Mol Weight 326.44 g/mol
Molecular Formula C21H26O3
Exact Mass 326.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DIFpj47HwB
Name Estra-1,3,5(10),15-tetraen-17.beta.-ol, 3-methoxy-, acetate
CAS Registry Number 19590-59-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O3
InChI InChI=1S/C21H26O3/c1-13(22)24-20-9-8-19-18-6-4-14-12-15(23-3)5-7-16(14)17(18)10-11-21(19,20)2/h5,7-9,12,17-20H,4,6,10-11H2,1-3H3
InChIKey IHCZGKUYOKUPDG-UHFFFAOYSA-N
Molecular Weight 326.436 g/mol
SMILES CC(=O)OC1C=CC2C3CCc4cc(ccc4C3CCC12C)OC
SPLASH splash10-001i-0591000000-4fe17086915b35da0c5e
Source of Spectrum W5-29229-0-0
Synonyms 3-Methoxyestra-1,3,5(10),15-tetraen-17-yl acetate (3-methoxy-13-methyl-6,7,8,9,11,12,14,17-octahydrocyclopenta[a]phenanthren-17-yl) acetate (3-methoxy-13-methyl-6,7,8,9,11,12,14,17-octahydrocyclopenta[a]phenanthren-17-yl) ethanoate Acetic acid (3-methoxy-13-methyl-6,7,8,9,11,12,14,17-octahydrocyclopenta[a]phenanthren-17-yl) ester
Wiley ID 1325080