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7a-Methyl-3-methoxy-D-homo-6-oxa-8a,14-estra-1,3,5(10)-trien-17a-one
SpectraBase Compound ID 6jZALVy9A3D
InChI InChI=1S/C20H26O3/c1-12-19-15(14-8-7-13(22-3)11-17(14)23-12)9-10-20(2)16(19)5-4-6-18(20)21/h7-8,11-12,15-16,19H,4-6,9-10H2,1-3H3/t12-,15+,16+,19-,20-/m0/s1
InChIKey FQFFWFVBDNQBTE-HDEUTIAISA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7LNBgdDFRF
Name 7a-Methyl-3-methoxy-D-homo-6-oxa-8a,14-estra-1,3,5(10)-trien-17a-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-12-19-15(14-8-7-13(22-3)11-17(14)23-12)9-10-20(2)16(19)5-4-6-18(20)21/h7-8,11-12,15-16,19H,4-6,9-10H2,1-3H3/t12-,15+,16+,19-,20-/m0/s1
InChIKey FQFFWFVBDNQBTE-HDEUTIAISA-N
Molecular Weight 314.425 g/mol
SMILES [C@@]12([C@@]([C@]3([C@@](Oc4c([C@]3(CC2)[H])ccc(c4)OC)(C)[H])[H])(CCCC1=O)[H])C
SPLASH splash10-0gvk-0394000000-7d2dbfb261735f84d0ff
Source of Spectrum O1-47-1237-2
Synonyms (4aR,4bS,5S,10bS,12aS)-8-methoxy-5,12a-dimethyl-3,4,4a,4b,5,10b,11,12-octahydro-2H-naphtho[1,2-c][1]benzopyran-1-one
Wiley ID 1690352