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Benzamide, 3-methyl-N-benzyl-N-heptyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzamide, 3-methyl-N-benzyl-N-heptyl-
SpectraBase Compound ID 3uG441Uib4i
InChI InChI=1S/C22H29NO/c1-3-4-5-6-10-16-23(18-20-13-8-7-9-14-20)22(24)21-15-11-12-19(2)17-21/h7-9,11-15,17H,3-6,10,16,18H2,1-2H3
InChIKey FVRDQIYBFDICOC-UHFFFAOYSA-N
Mol Weight 323.48 g/mol
Molecular Formula C22H29NO
Exact Mass 323.224915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LBphRuZ043p
Name Benzamide, 3-methyl-N-benzyl-N-heptyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.224914557 u
Formula C22H29NO
InChI InChI=1S/C22H29NO/c1-3-4-5-6-10-16-23(18-20-13-8-7-9-14-20)22(24)21-15-11-12-19(2)17-21/h7-9,11-15,17H,3-6,10,16,18H2,1-2H3
InChIKey FVRDQIYBFDICOC-UHFFFAOYSA-N
Molecular Weight 323.480 g/mol
SMILES C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C=1C=C(C=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956435