| SpectraBase Spectrum ID |
4mKcwPaZPoo |
| Name |
Butyramide, 2-phenyl-N-(2-pentyl)-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
345.303164879 u |
| Formula |
C23H39NO |
| InChI |
InChI=1S/C23H39NO/c1-6-10-15-20(8-3)18-24(19(5)14-7-2)23(25)22(9-4)21-16-12-11-13-17-21/h11-13,16-17,19-20,22H,6-10,14-15,18H2,1-5H3 |
| InChIKey |
DMDKDYYXXPKYAX-UHFFFAOYSA-N |
| Molecular Weight |
345.571 g/mol |
| SMILES |
C(N(CC(CCCC)CC)C(CCC)C)(=O)C(CC)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833867 |
