SpectraBase Spectrum ID |
BHYGGYrhVLL |
Name |
Butyrylamide, 2-phenyl-N-benzyl-N-hexyl- |
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/c1-3-5-6-13-18-24(19-20-14-9-7-10-15-20)23(25)22(4-2)21-16-11-8-12-17-21/h7-12,14-17,22H,3-6,13,18-19H2,1-2H3 |
InChIKey |
AMGMUAFTTCWJSZ-UHFFFAOYSA-N |
Molecular Weight |
337.507 g/mol |
SMILES |
C(N(CCCCCC)CC1=CC=CC=C1)(=O)C(CC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944348 |