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Benzamide, 3-methyl-N-(2-phenylethyl)-N-(2-heptyl)-
SpectraBase Compound ID 7COjfGzJ6aX
InChI InChI=1S/C23H31NO/c1-4-5-7-12-20(3)24(17-16-21-13-8-6-9-14-21)23(25)22-15-10-11-19(2)18-22/h6,8-11,13-15,18,20H,4-5,7,12,16-17H2,1-3H3
InChIKey VFCFHEBPDCTYLO-UHFFFAOYSA-N
Mol Weight 337.51 g/mol
Molecular Formula C23H31NO
Exact Mass 337.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LAkvchbF7r3
Name Benzamide, 3-methyl-N-(2-phenylethyl)-N-(2-heptyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.240564621 u
Formula C23H31NO
InChI InChI=1S/C23H31NO/c1-4-5-7-12-20(3)24(17-16-21-13-8-6-9-14-21)23(25)22-15-10-11-19(2)18-22/h6,8-11,13-15,18,20H,4-5,7,12,16-17H2,1-3H3
InChIKey VFCFHEBPDCTYLO-UHFFFAOYSA-N
Molecular Weight 337.507 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC=C(C)C1)C(CCCCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.95868