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3-Methoxy-8,14-seco-9-XI,14a-oxido-i,3,5(10)-estratrien-17-one
SpectraBase Compound ID 3B8Vgfe4hWS
InChI InChI=1S/C19H24O3/c1-18-10-11-19(22-17(18)8-7-16(18)20)9-3-4-13-12-14(21-2)5-6-15(13)19/h5-6,12,17H,3-4,7-11H2,1-2H3/t17-,18-,19+/m1/s1
InChIKey AKQKCDBGQKIVDA-QRVBRYPASA-N
Mol Weight 300.4 g/mol
Molecular Formula C19H24O3
Exact Mass 300.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58IMgnkgYy
Name 3-Methoxy-8,14-seco-9-XI,14a-oxido-i,3,5(10)-estratrien-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O3
InChI InChI=1S/C19H24O3/c1-18-10-11-19(22-17(18)8-7-16(18)20)9-3-4-13-12-14(21-2)5-6-15(13)19/h5-6,12,17H,3-4,7-11H2,1-2H3/t17-,18-,19+/m1/s1
InChIKey AKQKCDBGQKIVDA-QRVBRYPASA-N
Molecular Weight 300.398 g/mol
SMILES [C@]12([C@](O[C@]3(c4c(cc(OC)cc4)CCC3)CC1)(CCC2=O)[H])C
SPLASH splash10-100v-9203000000-a164fe7d11a49a5b4e86
Source of Spectrum JX-2015-6-12735
Synonyms (1'R,4aS,7aR)-6'-methoxy-4a-methyl-3',4,4a,4',7,7a-hexahydro-2'H,3H-spiro[cyclopenta[b]pyran-2,1'-naphthalen]-5(6H)-one
Wiley ID 1731329