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N-(2-Methylphenyl)butanamide
SpectraBase Compound ID DFqQEOHVg2h
InChI InChI=1S/C11H15NO/c1-3-6-11(13)12-10-8-5-4-7-9(10)2/h4-5,7-8H,3,6H2,1-2H3,(H,12,13)
InChIKey CTKWAPPTXSVBQK-UHFFFAOYSA-N
Mol Weight 177.25 g/mol
Molecular Formula C11H15NO
Exact Mass 177.115364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6w61lPhdcyV
Name N-(2-Methylphenyl)butanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 177.115364106 u
Formula C11H15NO
InChI InChI=1S/C11H15NO/c1-3-6-11(13)12-10-8-5-4-7-9(10)2/h4-5,7-8H,3,6H2,1-2H3,(H,12,13)
InChIKey CTKWAPPTXSVBQK-UHFFFAOYSA-N
Molecular Weight 177.247 g/mol
SMILES C=1(NC(CCC)=O)C(=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906235