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Estra-1,3,5(10)-triene-3,6,17-triol, (6.alpha.,17.beta.)-
SpectraBase Compound ID ISOdo6DyNwm
InChI InChI=1S/C18H24O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15-17,19-21H,4-7,9H2,1H3
InChIKey QZZRQURPSRWTLG-UHFFFAOYSA-N
Mol Weight 288.39 g/mol
Molecular Formula C18H24O3
Exact Mass 288.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Axz1gkrp5Bk
Name Estra-1,3,5(10)-triene-3,6,17-triol, (6.alpha.,17.beta.)-
CAS Registry Number 1229-24-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O3
InChI InChI=1S/C18H24O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15-17,19-21H,4-7,9H2,1H3
InChIKey QZZRQURPSRWTLG-UHFFFAOYSA-N
Molecular Weight 288.387 g/mol
SMILES OC1CCC2C1(CCC1C2CC(c2cc(ccc12)O)O)C
SPLASH splash10-05fr-0960000000-7df10c9d2e91c116e211
Source of Spectrum W5-25906-0-0
Synonyms Estra-1,3,5(10)-triene-3,6,17-triol 13-Methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6,17-triol
Wiley ID 1291957