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N-benzylacetoacetamide

View entire compound with spectra: 5 NMR, 1 FTIR, and 2 MS (GC)

N-benzylacetoacetamide
SpectraBase Compound ID 2eUpWQkx86
InChI InChI=1S/C11H13NO2/c1-9(13)7-11(14)12-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,12,14)
InChIKey KOHNUEXAOQRRPI-UHFFFAOYSA-N
Mol Weight 191.23 g/mol
Molecular Formula C11H13NO2
Exact Mass 191.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbCX1q6TxdY
Name N-Benzyl-3-oxobutanamide
Alternate Name(s) N-Benzyl-3-oxobutyramide 3-Oxidanylidene-N-(phenylmethyl)butanamide 3-Oxo-N-(phenylmethyl)butanamide N-benzyl-3-keto-butyramide N-benzyl-3-oxo-butanamide N-Benzylacetoacetamide
CAS Registry Number 882-36-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO2
InChI InChI=1S/C11H13NO2/c1-9(13)7-11(14)12-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,12,14)
InChIKey KOHNUEXAOQRRPI-UHFFFAOYSA-N
Molecular Weight 191.230 g/mol
SMILES N(C(CC(=O)C)=O)Cc1ccccc1
SPLASH splash10-0a4l-5900000000-065598800dcf8faeeb33
Wiley ID 1448661