| SpectraBase Compound ID | 55cUhY2iFrA |
|---|---|
| InChI | InChI=1S/C7H7NO4/c9-4-5-1-2-6(8(11)12)7(10)3-5/h1-3,9-10H,4H2 |
| InChIKey | YDFRYKXELURVHE-UHFFFAOYSA-N |
| Mol Weight | 169.14 g/mol |
| Molecular Formula | C7H7NO4 |
| Exact Mass | 169.037508 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Ap9LO0hg6V4 |
|---|---|
| Name | 3-Hydroxy-4-nitrobenzyl alcohol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.037507705 u |
| Formula | C7H7NO4 |
| InChI | InChI=1S/C7H7NO4/c9-4-5-1-2-6(8(11)12)7(10)3-5/h1-3,9-10H,4H2 |
| InChIKey | YDFRYKXELURVHE-UHFFFAOYSA-N |
| Molecular Weight | 169.136 g/mol |
| SMILES | OCC=1C=CC(=C(C1)O)N(=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.923581 |