| SpectraBase Compound ID | 9hjudxgBKfy |
|---|---|
| InChI | InChI=1S/C8H8N2O4/c1-5(11)9-7-4-6(12)2-3-8(7)10(13)14/h2-4,12H,1H3,(H,9,11) |
| InChIKey | AIYFITVQMIFCGJ-UHFFFAOYSA-N |
| Mol Weight | 196.16 g/mol |
| Molecular Formula | C8H8N2O4 |
| Exact Mass | 196.048407 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Gh1iTwJZ8y5 |
|---|---|
| Name | 5'-Hydoxy-2'-nitroacetanilide |
| 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/c1-5(11)9-7-4-6(12)2-3-8(7)10(13)14/h2-4,12H,1H3,(H,9,11) |
| InChIKey | AIYFITVQMIFCGJ-UHFFFAOYSA-N |
| Molecular Weight | 196.162 g/mol |
| SMILES | OC1=CC=C(C(=C1)NC(C)=O)N(=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.994277 |