| SpectraBase Compound ID | 3Czl3p6ar2p |
|---|---|
| InChI | InChI=1S/C8H8N2O4/c1-14-6-2-3-7(9-5-11)8(4-6)10(12)13/h2-5H,1H3,(H,9,11) |
| InChIKey | GTBAOJJGFILJRB-UHFFFAOYSA-N |
| Mol Weight | 196.16 g/mol |
| Molecular Formula | C8H8N2O4 |
| Exact Mass | 196.048407 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3X88Gdwvqro |
|---|---|
| Name | 4-Methoxy-2-nitroformanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.048406742 u |
| Formula | C8H8N2O4 |
| InChI | InChI=1S/C8H8N2O4/c1-14-6-2-3-7(9-5-11)8(4-6)10(12)13/h2-5H,1H3,(H,9,11) |
| InChIKey | GTBAOJJGFILJRB-UHFFFAOYSA-N |
| Molecular Weight | 196.162 g/mol |
| SMILES | C1(=C(C=CC(=C1)OC)NC=O)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93131 |