| SpectraBase Spectrum ID |
BcOZMoYWcdG |
| Name |
Benzamide, 4-butyl-N-allyl-N-octyl- |
| 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/c1-4-7-9-10-11-12-19-23(18-6-3)22(24)21-16-14-20(15-17-21)13-8-5-2/h6,14-17H,3-5,7-13,18-19H2,1-2H3 |
| InChIKey |
YCISOEGKBRKATL-UHFFFAOYSA-N |
| Molecular Weight |
329.528 g/mol |
| SMILES |
C(N(CCCCCCCC)CC=C)(=O)C=1C=CC(=CC1)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932608 |
