| SpectraBase Compound ID | DJXjxL7BA1D |
|---|---|
| InChI | InChI=1S/C9H8O3/c1-6(10)9(12)7-2-4-8(11)5-3-7/h2-5,11H,1H3 |
| InChIKey | PQRIZEYPOXNMDQ-UHFFFAOYSA-N |
| Mol Weight | 164.16 g/mol |
| Molecular Formula | C9H8O3 |
| Exact Mass | 164.047344 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 | JCMmM6bl0p6 |
|---|---|
| Name | 4-Hydroxyphenylacetylketone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.047344115 u |
| Formula | C9H8O3 |
| InChI | InChI=1S/C9H8O3/c1-6(10)9(12)7-2-4-8(11)5-3-7/h2-5,11H,1H3 |
| InChIKey | PQRIZEYPOXNMDQ-UHFFFAOYSA-N |
| Molecular Weight | 164.160 g/mol |
| SMILES | C1(=CC=C(C=C1)C(C(C)=O)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.906682 |