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D-3-methoxy-17-oxo-9(11)-secoestra-1,3,5(10)-trien-11-oic acid
SpectraBase Compound ID AyDhCVN55f8
InChI InChI=1S/C19H24O4/c1-19(11-18(21)22)16(7-8-17(19)20)14-4-3-13-10-15(23-2)6-5-12(13)9-14/h5-6,10,14,16H,3-4,7-9,11H2,1-2H3,(H,21,22)/t14?,16?,19-/m0/s1
InChIKey BQDRAUAYRIBGBL-KJXMEXGPSA-N
Mol Weight 316.4 g/mol
Molecular Formula C19H24O4
Exact Mass 316.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1lAOqv9KM3
Name D-3-methoxy-17-oxo-9(11)-secoestra-1,3,5(10)-trien-11-oic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O4
InChI InChI=1S/C19H24O4/c1-19(11-18(21)22)16(7-8-17(19)20)14-4-3-13-10-15(23-2)6-5-12(13)9-14/h5-6,10,14,16H,3-4,7-9,11H2,1-2H3,(H,21,22)/t14?,16?,19-/m0/s1
InChIKey BQDRAUAYRIBGBL-KJXMEXGPSA-N
Molecular Weight 316.397 g/mol
SMILES OC(C[C@]1(C(C2Cc3ccc(cc3CC2)OC)CCC1=O)C)=O
SPLASH splash10-02u0-0936000000-2744cb4ffc10643c343a
Source of Spectrum F-32-83-1
Synonyms [(1S)-2-(6-methoxy-1,2,3,4-tetrahydro-2-naphthalenyl)-1-methyl-5-oxocyclopentyl]acetic acid
Wiley ID 1316903