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17β-Estradiol 3-methyl ether
SpectraBase Compound ID 79BWVcPZs1R
InChI InChI=1S/C19H26O2/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/h4,6,11,15-18,20H,3,5,7-10H2,1-2H3/t15-,16-,17+,18+,19+/m1/s1
InChIKey ULAADVBNYHGIBP-GFEQUFNTSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ZQKo3vXea4
Name 3-Methoxyestra-1,3,5(10)-trien-17.beta.-ol
CAS Registry Number 1035-77-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O2
InChI InChI=1S/C19H26O2/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/h4,6,11,15-18,20H,3,5,7-10H2,1-2H3/t15-,16-,17+,18+,19+/m1/s1
InChIKey ULAADVBNYHGIBP-GFEQUFNTSA-N
Molecular Weight 286.415 g/mol
SMILES O[C@]1(CC[C@]2([C@@]3(CCc4cc(ccc4[C@]3(CC[C@]12C)[H])OC)[H])[H])[H]
SPLASH splash10-000i-0490000000-d4b5e1b38b8b27b5bb67
Source of Spectrum D8-327-640-1
Synonyms (8R,9S,13S,14S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
Wiley ID 1515498