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4,5-Dimethoxy-2-methyl-2'-(methoxymethyl)cinnamonitrile
SpectraBase Compound ID 9CPOSRmiJ3
InChI InChI=1S/C14H17NO3/c1-10-7-13(17-3)14(18-4)8-12(10)11(5-6-15)9-16-2/h5,7-8H,9H2,1-4H3/b11-5+
InChIKey AFTSEHPJRDZGSW-VZUCSPMQSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NRlhJjAhmS
Name 4,5-Dimethoxy-2-methyl-2'-(methoxymethyl)cinnamonitrile
Alternate Name(s) (2Z)-3-(4,5-dimethoxy-2-methylphenyl)-4-methoxy-2-butenenitrile (Z)-3-(4,5-dimethoxy-2-methyl-phenyl)-4-methoxy-but-2-enenitrile (Z)-3-(4,5-dimethoxy-2-methylphenyl)-4-methoxy-2-butenenitrile
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Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-10-7-13(17-3)14(18-4)8-12(10)11(5-6-15)9-16-2/h5,7-8H,9H2,1-4H3/b11-5+
InChIKey AFTSEHPJRDZGSW-VZUCSPMQSA-N
Molecular Weight 247.294 g/mol
SMILES c1(cc(OC)c(cc1C)OC)\C(=C\C#N)COC
SPLASH splash10-00kb-0090000000-39b529ce21b03cef5a56
Source of Spectrum J-57-3533-20
Wiley ID 1250080