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(4R*,4aS*,8aR*)-2-Phenyl-4-( 4'-methoxyphenyl)-1,4,4a,5,6,7,8,8a-octahydro-1,8-dioxanaphtho-3-carbonitrile
SpectraBase Compound ID Fwc2asBzXxE
InChI InChI=1S/C22H21NO3/c1-24-17-11-9-15(10-12-17)20-18-8-5-13-25-22(18)26-21(19(20)14-23)16-6-3-2-4-7-16/h2-4,6-7,9-12,18,20,22H,5,8,13H2,1H3
InChIKey VCFFDMNYNVJHFE-UHFFFAOYSA-N
Mol Weight 347.41 g/mol
Molecular Formula C22H21NO3
Exact Mass 347.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CF67zRPEgIl
Name (4R*,4aS*,8aR*)-2-Phenyl-4-( 4'-methoxyphenyl)-1,4,4a,5,6,7,8,8a-octahydro-1,8-dioxanaphtho-3-carbonitrile
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Formula C22H21NO3
InChI InChI=1S/C22H21NO3/c1-24-17-11-9-15(10-12-17)20-18-8-5-13-25-22(18)26-21(19(20)14-23)16-6-3-2-4-7-16/h2-4,6-7,9-12,18,20,22H,5,8,13H2,1H3
InChIKey VCFFDMNYNVJHFE-UHFFFAOYSA-N
Molecular Weight 347.414 g/mol
SMILES C1(=C(OC2C(C1c1ccc(cc1)OC)CCCO2)c1ccccc1)C#N
SPLASH splash10-03di-1293000000-249f4dcfda8ee0c96543
Source of Spectrum AH-128-1170-6
Synonyms 5-(4-Methoxyphenyl)-7-phenyl-3,4,4a,8a-tetrahydro-2H,5H-pyrano[2,3-b]pyran-6-carbonitrile
Wiley ID 1340138