SpectraBase Spectrum ID |
4hW1K6mEeiY |
Name |
Acetamide, 2-phenyl-N-(2-butyl)-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
275.224914557 u |
Formula |
C18H29NO |
InChI |
InChI=1S/C18H29NO/c1-4-6-7-11-14-19(16(3)5-2)18(20)15-17-12-9-8-10-13-17/h8-10,12-13,16H,4-7,11,14-15H2,1-3H3 |
InChIKey |
HPIAYCSKPVANBI-UHFFFAOYSA-N |
SMILES |
C(N(CCCCCC)C(CC)C)(=O)CC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811736 |