SpectraBase Spectrum ID |
4502CeRvP0Q |
Name |
Cyclohexanecarboxamide, N-benzyl-N-butyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
273.209264492 u |
Formula |
C18H27NO |
InChI |
InChI=1S/C18H27NO/c1-2-3-14-19(15-16-10-6-4-7-11-16)18(20)17-12-8-5-9-13-17/h4,6-7,10-11,17H,2-3,5,8-9,12-15H2,1H3 |
InChIKey |
GPVAMLSVYCLDGQ-UHFFFAOYSA-N |
Molecular Weight |
273.420 g/mol |
SMILES |
C(N(CCCC)CC1=CC=CC=C1)(=O)C1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930954 |