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(4S,6aR)-4-(6-methoxy-2-naphthyl)-3a-methyl-2-oxohexahydro-6aH-cyclopenta[b]furan-6a-carbonitrile
SpectraBase Compound ID KAXX39wq6cb
InChI InChI=1S/C20H19NO3/c1-19-11-18(22)24-20(19,12-21)8-7-17(19)15-4-3-14-10-16(23-2)6-5-13(14)9-15/h3-6,9-10,17H,7-8,11H2,1-2H3/t17-,19?,20-/m0/s1
InChIKey SQDAEUQHBWVDPS-SPFPWHRZSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JErvTTogQSn
Name (4S,6aR)-4-(6-methoxy-2-naphthyl)-3a-methyl-2-oxohexahydro-6aH-cyclopenta[b]furan-6a-carbonitrile
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Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-19-11-18(22)24-20(19,12-21)8-7-17(19)15-4-3-14-10-16(23-2)6-5-13(14)9-15/h3-6,9-10,17H,7-8,11H2,1-2H3/t17-,19?,20-/m0/s1
InChIKey SQDAEUQHBWVDPS-SPFPWHRZSA-N
Molecular Weight 321.376 g/mol
SMILES C12([C@@](OC(C2)=O)(C#N)CC[C@]1(c1cc2ccc(cc2cc1)OC)[H])C
SPLASH splash10-00di-0709000000-6e0cf59ddbac959f1849
Source of Spectrum F-32-84-2
Synonyms RAC-3-METHOXY-17.ALPHA.-HYDROXY-17.BETA.-CYANO-9(11)-SECO-14-ISOESTRA-1,3,5(10),6,8-PENTAEN-11-OICACID LACTONE(11-17)
Wiley ID 1321047