| SpectraBase Compound ID | 4US6KgiAkkb |
|---|---|
| InChI | InChI=1S/C8H7NO3/c1-2-6-5-7(9(11)12)3-4-8(6)10/h2-5,10H,1H2 |
| InChIKey | GCJWTWRUOBPGGO-UHFFFAOYSA-N |
| Mol Weight | 165.15 g/mol |
| Molecular Formula | C8H7NO3 |
| Exact Mass | 165.042593 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BOhsOBAF8XH |
|---|---|
| Name | 4-Nitro-2-vinylphenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.042593086 u |
| Formula | C8H7NO3 |
| InChI | InChI=1S/C8H7NO3/c1-2-6-5-7(9(11)12)3-4-8(6)10/h2-5,10H,1H2 |
| InChIKey | GCJWTWRUOBPGGO-UHFFFAOYSA-N |
| Molecular Weight | 165.148 g/mol |
| SMILES | C1(N(=O)=O)=CC(C=C)=C(C=C1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927534 |