| SpectraBase Compound ID | 3wi5DEwULYC |
|---|---|
| InChI | InChI=1S/C8H6O4/c9-4-5-2-1-3-6(7(5)10)8(11)12/h1-4,10H,(H,11,12) |
| InChIKey | YOEUNKPREOJHBW-UHFFFAOYSA-N |
| Mol Weight | 166.13 g/mol |
| Molecular Formula | C8H6O4 |
| Exact Mass | 166.026609 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AvcwwtH1fJU |
|---|---|
| Name | 3-Formyl-2-hydroxybenzoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.026608669 u |
| Formula | C8H6O4 |
| InChI | InChI=1S/C8H6O4/c9-4-5-2-1-3-6(7(5)10)8(11)12/h1-4,10H,(H,11,12) |
| InChIKey | YOEUNKPREOJHBW-UHFFFAOYSA-N |
| Molecular Weight | 166.132 g/mol |
| SMILES | C(=O)C1=C(O)C(C(O)=O)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947767 |