| SpectraBase Compound ID | An6NkdNyxXO |
|---|---|
| InChI | InChI=1S/C10H8O3/c11-8-6-13-10(12)9(8)7-4-2-1-3-5-7/h1-5,11H,6H2 |
| InChIKey | BDTGRWGPYLECRW-UHFFFAOYSA-N |
| Mol Weight | 176.17 g/mol |
| Molecular Formula | C10H8O3 |
| Exact Mass | 176.047344 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | A4HHvlttURW |
|---|---|
| Name | 4-Hydroxy-3-phenyl-2(5H)-furanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.047344115 u |
| Formula | C10H8O3 |
| InChI | InChI=1S/C10H8O3/c11-8-6-13-10(12)9(8)7-4-2-1-3-5-7/h1-5,11H,6H2 |
| InChIKey | BDTGRWGPYLECRW-UHFFFAOYSA-N |
| Molecular Weight | 176.171 g/mol |
| SMILES | C=1(C(OCC1O)=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.910513 |