| SpectraBase Spectrum ID |
ITsPJ8XFkuD |
| Name |
Benzamide, 3,5-dinitro-N-carbamoylmethyl-N-(2-tolyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
358.091334181 u |
| Formula |
C16H14N4O6 |
| InChI |
InChI=1S/C16H14N4O6/c1-10-4-2-3-5-14(10)18(9-15(17)21)16(22)11-6-12(19(23)24)8-13(7-11)20(25)26/h2-8H,9H2,1H3,(H2,17,21) |
| InChIKey |
SLWFQONYARWDHK-UHFFFAOYSA-N |
| Molecular Weight |
358.310 g/mol |
| SMILES |
C(C(N)=O)N(C(=O)C1=CC(=CC(=C1)N(=O)=O)N(=O)=O)C=1C(C)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.861714 |
