| SpectraBase Compound ID | CeCA0ZuL7cm |
|---|---|
| InChI | InChI=1S/C12H9NO3/c14-11-8-4-7-10(12(11)13(15)16)9-5-2-1-3-6-9/h1-8,14H |
| InChIKey | DRGIJTNVBHIOFB-UHFFFAOYSA-N |
| Mol Weight | 215.21 g/mol |
| Molecular Formula | C12H9NO3 |
| Exact Mass | 215.058243 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Aug3pcrojVm |
|---|---|
| Name | 2-Nitro-3-phenylphenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.058243151 u |
| Formula | C12H9NO3 |
| InChI | InChI=1S/C12H9NO3/c14-11-8-4-7-10(12(11)13(15)16)9-5-2-1-3-6-9/h1-8,14H |
| InChIKey | DRGIJTNVBHIOFB-UHFFFAOYSA-N |
| Molecular Weight | 215.208 g/mol |
| SMILES | OC=1C(=C(C=CC1)C=1C=CC=CC1)N(=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.873218 |