| SpectraBase Compound ID | 8LAyNrHTvU4 |
|---|---|
| InChI | InChI=1S/C10H6O4/c11-7-8(12)10(13)14-9(7)6-4-2-1-3-5-6/h1-5,9H |
| InChIKey | OIYUNDWAIWJGBI-UHFFFAOYSA-N |
| Mol Weight | 190.15 g/mol |
| Molecular Formula | C10H6O4 |
| Exact Mass | 190.026609 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6183vbpLUUm |
|---|---|
| Name | 2,3-Dioxo-4-phenyl butyrolactone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.026608669 u |
| Formula | C10H6O4 |
| InChI | InChI=1S/C10H6O4/c11-7-8(12)10(13)14-9(7)6-4-2-1-3-5-6/h1-5,9H |
| InChIKey | OIYUNDWAIWJGBI-UHFFFAOYSA-N |
| Molecular Weight | 190.154 g/mol |
| SMILES | C1(C(C(C(O1)C=1C=CC=CC1)=O)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93469 |