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Methyl 1-[17'-oxo-3'-methoxy-1',3',5'(10')-estratrien-16.beta.-yl]formate
SpectraBase Compound ID 7SIHV73bJqG
InChI InChI=1S/C21H26O4/c1-21-9-8-15-14-7-5-13(24-2)10-12(14)4-6-16(15)18(21)11-17(19(21)22)20(23)25-3/h5,7,10,15-18H,4,6,8-9,11H2,1-3H3/t15?,16?,17-,18?,21-/m0/s1
InChIKey LSHBHSFAOXGHPP-FNJUFLHCSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwMk39Xd9qt
Name Methyl 1-[17'-oxo-3'-methoxy-1',3',5'(10')-estratrien-16.beta.-yl]formate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-21-9-8-15-14-7-5-13(24-2)10-12(14)4-6-16(15)18(21)11-17(19(21)22)20(23)25-3/h5,7,10,15-18H,4,6,8-9,11H2,1-3H3/t15?,16?,17-,18?,21-/m0/s1
InChIKey LSHBHSFAOXGHPP-FNJUFLHCSA-N
Molecular Weight 342.435 g/mol
SMILES [C@@]12(C(C3CCc4c(C3CC2)ccc(OC)c4)C[C@@](C1=O)(C(=O)OC)[H])C
SPLASH splash10-001j-0590000000-318ce550b1cba4dae73a
Source of Spectrum SK-25-2490-2
Synonyms Methyl (16beta)-3-methoxy-17-oxoestra-1,3,5(10)-triene-16-carboxylate
Wiley ID 866904