| SpectraBase Compound ID | B04rzXYuqWB |
|---|---|
| InChI | InChI=1S/C12H8ClNO4/c13-8-1-3-9(4-2-8)18-10-5-6-11(14(16)17)12(15)7-10/h1-7,15H |
| InChIKey | JYOOHHLNDUOSDA-UHFFFAOYSA-N |
| Mol Weight | 265.65 g/mol |
| Molecular Formula | C12H8ClNO4 |
| Exact Mass | 265.014185 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FNDrmsmGaS6 |
|---|---|
| Name | Benzene, 1-nitro-2-hydroxy-4-(p-chlorophenoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.014185438 u |
| Formula | C12H8ClNO4 |
| InChI | InChI=1S/C12H8ClNO4/c13-8-1-3-9(4-2-8)18-10-5-6-11(14(16)17)12(15)7-10/h1-7,15H |
| InChIKey | JYOOHHLNDUOSDA-UHFFFAOYSA-N |
| SMILES | C1(OC2=CC=C(Cl)C=C2)=CC(=C(C=C1)N(=O)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915618 |