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(RS)-3-Benzoyloxy-4-cyanobutanoic acid amide
SpectraBase Compound ID FOApvNNoyTb
InChI InChI=1S/C12H12N2O3/c13-7-6-10(8-11(14)15)17-12(16)9-4-2-1-3-5-9/h1-5,10H,6,8H2,(H2,14,15)
InChIKey UWODBLUTOIQGSI-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C12H12N2O3
Exact Mass 232.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9HGPxbR5T2
Name (RS)-3-Benzoyloxy-4-cyanobutanoic acid amide
Alternate Name(s) Benzoic acid 1-carbamoylmethyl-2-cyano-ethyl ester benzoic acid (4-amino-1-cyano-4-oxobutan-2-yl) ester (4-amino-1-cyano-4-oxobutan-2-yl) benzoate [3-amino-1-(cyanomethyl)-3-oxo-propyl] benzoate (4-azanyl-1-cyano-4-oxidanylidene-butan-2-yl) benzoate
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Formula C12H12N2O3
InChI InChI=1S/C12H12N2O3/c13-7-6-10(8-11(14)15)17-12(16)9-4-2-1-3-5-9/h1-5,10H,6,8H2,(H2,14,15)
InChIKey UWODBLUTOIQGSI-UHFFFAOYSA-N
Molecular Weight 232.239 g/mol
SMILES NC(CC(OC(=O)c1ccccc1)CC#N)=O
SPLASH splash10-0a4j-0900000000-9bc74ddb71ae3746c90b
Source of Spectrum G2-2-453-7
Wiley ID 1661499