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Estra-1,3,5(10)-trien-17-ol, 2,3,4-trimethoxy-, (17.beta.)-
SpectraBase Compound ID 1XWqtZJqg2J
InChI InChI=1S/C21H30O4/c1-21-10-9-12-13(16(21)7-8-18(21)22)5-6-14-15(12)11-17(23-2)20(25-4)19(14)24-3/h11-13,16,18,22H,5-10H2,1-4H3
InChIKey HRVXCJHYWIFSOQ-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tYdB3J9Rg5
Name Estra-1,3,5(10)-trien-17-ol, 2,3,4-trimethoxy-, (17.beta.)-
Alternate Name(s) 2,3,4-trimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol Estra-1,3,5(10)-trien-17.beta.-ol, 2,3,4-trimethoxy- MP 2001
CAS Registry Number 4314-54-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-21-10-9-12-13(16(21)7-8-18(21)22)5-6-14-15(12)11-17(23-2)20(25-4)19(14)24-3/h11-13,16,18,22H,5-10H2,1-4H3
InChIKey HRVXCJHYWIFSOQ-UHFFFAOYSA-N
Molecular Weight 346.467 g/mol
SMILES OC1CCC2C3CCc4c(cc(c(c4OC)OC)OC)C3CCC12C
SPLASH splash10-0002-0349000000-82d70e5eecf40d70e216
Source of Spectrum W5-30637-0-0
Wiley ID 1339446