SpectraBase Spectrum ID |
Jkn4T7F7fUr |
Name |
Cyclohexanecarboxamide, N-benzyl-N-hexadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
441.397065265 u |
Formula |
C30H51NO |
InChI |
InChI=1S/C30H51NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-26-31(27-28-22-17-15-18-23-28)30(32)29-24-19-16-20-25-29/h15,17-18,22-23,29H,2-14,16,19-21,24-27H2,1H3 |
InChIKey |
ZIEJKJRRRWIFAN-UHFFFAOYSA-N |
Molecular Weight |
441.744 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.881397 |