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Methyl 4-allyl-5-(2-cyanoethyl)-3-hydroxybiphenyl-2-carboxylate
SpectraBase Compound ID DPViFSlYgy5
InChI InChI=1S/C20H19NO3/c1-3-8-16-15(11-7-12-21)13-17(14-9-5-4-6-10-14)18(19(16)22)20(23)24-2/h3-6,9-10,13,22H,1,7-8,11H2,2H3
InChIKey KZJVINORODMEPC-UHFFFAOYSA-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 9pf6vLsClbv
Name Methyl 4-allyl-5-(2-cyanoethyl)-3-hydroxybiphenyl-2-carboxylate
Alternate Name(s) Methyl 4-allyl-5-(2-cyanoethyl)-3-hydroxy-[1,1'-biphenyl]-2-carboxylate
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Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-3-8-16-15(11-7-12-21)13-17(14-9-5-4-6-10-14)18(19(16)22)20(23)24-2/h3-6,9-10,13,22H,1,7-8,11H2,2H3
InChIKey KZJVINORODMEPC-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES Oc1c(c(cc(c1CC=C)CCC#N)-c1ccccc1)C(=O)OC
SPLASH splash10-00dr-0093000000-39d515d431caca139930
Source of Spectrum H-96-2190-5i
Wiley ID 1784626