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Acetoacetamide, N,N-dimethyl-2-o-tolyl-

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

Acetoacetamide, N,N-dimethyl-2-o-tolyl-
SpectraBase Compound ID 3Vq6AiL8M9S
InChI InChI=1S/C13H17NO2/c1-9-7-5-6-8-11(9)12(10(2)15)13(16)14(3)4/h5-8,12H,1-4H3
InChIKey JOZPJXNIDLULIK-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 84stT8OOFPV
Name Acetoacetamide, N,N-dimethyl-2-o-tolyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.125928789 u
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-9-7-5-6-8-11(9)12(10(2)15)13(16)14(3)4/h5-8,12H,1-4H3
InChIKey JOZPJXNIDLULIK-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES C1=CC=C(C(=C1)C)C(C(C)=O)C(N(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966794