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2-Butenamide, N-(3-methylphenyl)-3-methyl-

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2-Butenamide, N-(3-methylphenyl)-3-methyl-
SpectraBase Compound ID HMfUVU1a7RZ
InChI InChI=1S/C12H15NO/c1-9(2)7-12(14)13-11-6-4-5-10(3)8-11/h4-8H,1-3H3,(H,13,14)
InChIKey BBEWYYXUPWRIRQ-UHFFFAOYSA-N
Mol Weight 189.26 g/mol
Molecular Formula C12H15NO
Exact Mass 189.115364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4dEtLOssOMJ
Name 2-Butenamide, N-(3-methylphenyl)-3-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.115364106 u
Formula C12H15NO
InChI InChI=1S/C12H15NO/c1-9(2)7-12(14)13-11-6-4-5-10(3)8-11/h4-8H,1-3H3,(H,13,14)
InChIKey BBEWYYXUPWRIRQ-UHFFFAOYSA-N
Molecular Weight 189.258 g/mol
SMILES CC(C)=CC(NC1=CC=CC(C)=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.837728