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1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,4a,4b,5,6,7,8,10,10a-decahydro-3-hydroxy-4a,7-dimethyl-2-oxo-, methyl ester, [1S-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,10a.alpha.)]-

View entire compound with spectra: 1 MS (GC)

1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,4a,4b,5,6,7,8,10,10a-decahydro-3-hydroxy-4a,7-dimethyl-2-oxo-, methyl ester, [1S-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,10a.alpha.)]-
SpectraBase Compound ID 1fMuBAZE6Yn
InChI InChI=1S/C20H26O4/c1-5-19(2)9-8-13-12(10-19)6-7-14-16(18(23)24-4)17(22)15(21)11-20(13,14)3/h5-6,11,13-14,16,21H,1,7-10H2,2-4H3
InChIKey ARWWFIBDNBUWPD-UHFFFAOYSA-N
Mol Weight 330.42 g/mol
Molecular Formula C20H26O4
Exact Mass 330.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11nKzpLmt29
Name 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,4a,4b,5,6,7,8,10,10a-decahydro-3-hydroxy-4a,7-dimethyl-2-oxo-, methyl ester, [1S-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,10a.alpha.)]-
CAS Registry Number 57397-04-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O4
InChI InChI=1S/C20H26O4/c1-5-19(2)9-8-13-12(10-19)6-7-14-16(18(23)24-4)17(22)15(21)11-20(13,14)3/h5-6,11,13-14,16,21H,1,7-10H2,2-4H3
InChIKey ARWWFIBDNBUWPD-UHFFFAOYSA-N
Molecular Weight 330.424 g/mol
SMILES OC1=CC2(C)C3C(=CCC2C(C1=O)C(OC)=O)CC(C=C)(C)CC3
SPLASH splash10-00dl-8911000000-8d99dbb2209367e2b77f
Source of Spectrum W5-29541-0-0
Synonyms Methyl 3-hydroxy-4a,7-dimethyl-2-oxo-7-vinyl-1,2,4a,4b,5,6,7,8,10,10a-decahydro-1-phenanthrenecarboxylate 3-Hydroxy-2-keto-4a,7-dimethyl-7-vinyl-4b,5,6,8,10,10a-hexahydro-1H-phenanthrene-1-carboxylic acid methyl ester 7-Ethenyl-3-hydroxy-4a,7-dimethyl-2-oxo-4b,5,6,8,10,10a-hexahydro-1H-phenanthrene-1-carboxylic acid methyl ester Methyl 3-hydroxy-4a,7-dimethyl-2-oxo-7-vinyl-4b,5,6,8,10,10a-hexahydro-1H-phenanthrene-1-carboxylate Methyl 7-ethenyl-3-hydroxy-4a,7-dimethyl-2-oxo-4b,5,6,8,10,10a-hexahydro-1H-phenanthrene-1-carboxylate Methyl 7-ethenyl-4a,7-dimethyl-3-oxidanyl-2-oxidanylidene-4b,5,6,8,10,10a-hexahydro-1H-phenanthrene-1-carboxylate
Wiley ID 1328042