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Cyano-[(4'-methoxyphenyl)methyl] butyrate
SpectraBase Compound ID 3KyNGQJnl8E
InChI InChI=1S/C13H15NO3/c1-3-4-13(15)17-12(9-14)10-5-7-11(16-2)8-6-10/h5-8,12H,3-4H2,1-2H3
InChIKey SVVIMJSSCAVRCY-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bt4Dcq8OOKP
Name Cyano-[(4'-methoxyphenyl)methyl] butyrate
Alternate Name(s) (S)-(+)-Cyano(4-methoxyphenyl)methyl butyrate Butanoic acid[cyano-(4-methoxyphenyl)methyl]ester Butyric acid[cyano-(4-methoxyphenyl)methyl]ester cyano(4-methoxyphenyl)methyl butyrate [cyano-(4-methoxyphenyl)methyl]butanoate Butanoic acid [cyano-(4-methoxyphenyl)methyl] ester [cyano-(4-methoxyphenyl)methyl] butanoate
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Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-3-4-13(15)17-12(9-14)10-5-7-11(16-2)8-6-10/h5-8,12H,3-4H2,1-2H3
InChIKey SVVIMJSSCAVRCY-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES C(#N)C(OC(=O)CCC)c1ccc(cc1)OC
SPLASH splash10-000b-1910000000-f5f21ba35eb628699cb7
Source of Spectrum U1-2002-1521-7
Wiley ID 1522323