| SpectraBase Compound ID | 7BQVFdkI334 |
|---|---|
| InChI | InChI=1S/C8H8O3/c1-6(9)11-8-4-2-7(10)3-5-8/h2-5,10H,1H3 |
| InChIKey | HBMCQTHGYMTCOF-UHFFFAOYSA-N |
| Mol Weight | 152.15 g/mol |
| Molecular Formula | C8H8O3 |
| Exact Mass | 152.047344 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BPMNIDQTL9 |
|---|---|
| Name | Quinol-monoacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.047344115 u |
| Formula | C8H8O3 |
| InChI | InChI=1S/C8H8O3/c1-6(9)11-8-4-2-7(10)3-5-8/h2-5,10H,1H3 |
| InChIKey | HBMCQTHGYMTCOF-UHFFFAOYSA-N |
| Molecular Weight | 152.149 g/mol |
| SMILES | C1(O)=CC=C(C=C1)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.970431 |