SpectraBase Spectrum ID |
4Fwt7lu22zk |
Name |
Cyclopentanecarboxamide, N-(2-phenylethyl)-N-tetradecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
413.365765136 u |
Formula |
C28H47NO |
InChI |
InChI=1S/C28H47NO/c1-2-3-4-5-6-7-8-9-10-11-12-18-24-29(28(30)27-21-16-17-22-27)25-23-26-19-14-13-15-20-26/h13-15,19-20,27H,2-12,16-18,21-25H2,1H3 |
InChIKey |
BSNUTRUKKYXVAL-UHFFFAOYSA-N |
Molecular Weight |
413.690 g/mol |
SMILES |
C1(=CC=CC=C1)CCN(C(=O)C1CCCC1)CCCCCCCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.848444 |