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o-Toluylamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-
SpectraBase Compound ID 7O96Sb6AaUs
InChI InChI=1S/C24H33NO/c1-4-6-13-21(5-2)19-25(18-17-22-14-8-7-9-15-22)24(26)23-16-11-10-12-20(23)3/h7-12,14-16,21H,4-6,13,17-19H2,1-3H3
InChIKey LQPZSBWPZFCKQM-UHFFFAOYSA-N
Mol Weight 351.5 g/mol
Molecular Formula C24H33NO
Exact Mass 351.256215 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hy3AM66tqDc
Name o-Toluylamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.256214686 u
Formula C24H33NO
InChI InChI=1S/C24H33NO/c1-4-6-13-21(5-2)19-25(18-17-22-14-8-7-9-15-22)24(26)23-16-11-10-12-20(23)3/h7-12,14-16,21H,4-6,13,17-19H2,1-3H3
InChIKey LQPZSBWPZFCKQM-UHFFFAOYSA-N
Molecular Weight 351.534 g/mol
SMILES C1(=C(C=CC=C1)C(N(CC(CCCC)CC)CCC1=CC=CC=C1)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957913