| SpectraBase Spectrum ID |
JcO26rJ56MJ |
| Name |
Cyclopentanecarboxamide, N-(2-phenylethyl)-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.271864750 u |
| Formula |
C22H35NO |
| InChI |
InChI=1S/C22H35NO/c1-3-5-11-19(4-2)18-23(22(24)21-14-9-10-15-21)17-16-20-12-7-6-8-13-20/h6-8,12-13,19,21H,3-5,9-11,14-18H2,1-2H3 |
| InChIKey |
QUEXTACNSGBRFG-UHFFFAOYSA-N |
| Molecular Weight |
329.528 g/mol |
| SMILES |
C1(=CC=CC=C1)CCN(C(=O)C1CCCC1)CC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90439 |
