| SpectraBase Spectrum ID |
60U2HkcGV3c |
| Name |
Benzamide, 2-bromo-N-(2-pentyl)-N-decyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
409.198027782 u |
| Formula |
C22H36BrNO |
| InChI |
InChI=1S/C22H36BrNO/c1-4-6-7-8-9-10-11-14-18-24(19(3)15-5-2)22(25)20-16-12-13-17-21(20)23/h12-13,16-17,19H,4-11,14-15,18H2,1-3H3 |
| InChIKey |
UXYOVPVPJITGCE-UHFFFAOYSA-N |
| Molecular Weight |
410.440 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C=1C(Br)=CC=CC1)CCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810908 |
