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Estra-1,3,5(10)-triene-3,17-diol, 6-methoxy-, (6.alpha.,17.beta.)-
SpectraBase Compound ID 7n3CAlDKFAQ
InChI InChI=1S/C19H26O3/c1-19-8-7-13-12-4-3-11(20)9-15(12)17(22-2)10-14(13)16(19)5-6-18(19)21/h3-4,9,13-14,16-18,20-21H,5-8,10H2,1-2H3
InChIKey ZXHOGDYDNZUTSO-UHFFFAOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EP4oXpBlBzg
Name Estra-1,3,5(10)-triene-3,17-diol, 6-methoxy-, (6.alpha.,17.beta.)-
CAS Registry Number 74312-88-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-19-8-7-13-12-4-3-11(20)9-15(12)17(22-2)10-14(13)16(19)5-6-18(19)21/h3-4,9,13-14,16-18,20-21H,5-8,10H2,1-2H3
InChIKey ZXHOGDYDNZUTSO-UHFFFAOYSA-N
Molecular Weight 302.414 g/mol
SMILES OC1CCC2C1(CCC1C2CC(c2c1ccc(c2)O)OC)C
SPLASH splash10-05fr-0970000000-7b61849d642f44bec75f
Source of Spectrum W5-27244-0-0
Synonyms 6-Methoxyestra-1,3,5(10)-triene-3,17-diol 6-Methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Wiley ID 1304921