| SpectraBase Spectrum ID |
8GAoRltiNu1 |
| Name |
Benzamide, 4-nitro-N-(2-butyl)-N-butyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
278.163042573 u |
| Formula |
C15H22N2O3 |
| InChI |
InChI=1S/C15H22N2O3/c1-4-6-11-16(12(3)5-2)15(18)13-7-9-14(10-8-13)17(19)20/h7-10,12H,4-6,11H2,1-3H3 |
| InChIKey |
BVFBIZSJXMCESP-UHFFFAOYSA-N |
| SMILES |
C(C1=CC=C(C=C1)N(=O)=O)(=O)N(CCCC)C(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826494 |
