| SpectraBase Spectrum ID |
CxluQ4Fqfsi |
| Name |
Benzamide, 4-(tert-butyl)-N-(2-pentyl)-N-heptyl- |
| 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/c1-7-9-10-11-12-18-24(19(3)13-8-2)22(25)20-14-16-21(17-15-20)23(4,5)6/h14-17,19H,7-13,18H2,1-6H3 |
| InChIKey |
GOFZJBAOPJDMGC-UHFFFAOYSA-N |
| Molecular Weight |
345.571 g/mol |
| SMILES |
C(N(CCCCCCC)C(CCC)C)(=O)C=1C=CC(=CC1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944719 |
