| SpectraBase Spectrum ID |
3ksl3aXDr1u |
| Name |
Benzamide, 4-nitro-N-butyl-N-nonyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.241292895 u |
| Formula |
C20H32N2O3 |
| InChI |
InChI=1S/C20H32N2O3/c1-3-5-7-8-9-10-11-17-21(16-6-4-2)20(23)18-12-14-19(15-13-18)22(24)25/h12-15H,3-11,16-17H2,1-2H3 |
| InChIKey |
OVDYNWKHBYTHLN-UHFFFAOYSA-N |
| Molecular Weight |
348.487 g/mol |
| SMILES |
C(C1=CC=C(C=C1)N(=O)=O)(=O)N(CCCC)CCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828863 |
