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3-Methyl-N-(3-methylbenzyl)benzamide

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

3-Methyl-N-(3-methylbenzyl)benzamide
SpectraBase Compound ID 2N9nGAlpio1
InChI InChI=1S/C16H17NO/c1-12-5-3-7-14(9-12)11-17-16(18)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3,(H,17,18)
InChIKey IWTWOBQRYAOYPX-UHFFFAOYSA-N
Mol Weight 239.32 g/mol
Molecular Formula C16H17NO
Exact Mass 239.131014 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1VQ0L8RqibE
Name 3-Methyl-N-(3-methylbenzyl)benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.131014170 u
Formula C16H17NO
InChI InChI=1S/C16H17NO/c1-12-5-3-7-14(9-12)11-17-16(18)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3,(H,17,18)
InChIKey IWTWOBQRYAOYPX-UHFFFAOYSA-N
Molecular Weight 239.318 g/mol
SMILES C=1(C(NCC2=CC(=CC=C2)C)=O)C=C(C=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.866148