| SpectraBase Compound ID | 9hwrST0ZUzO |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-8(2)6-11(13)14-10-5-3-4-9(12)7-10/h3-7,12H,1-2H3 |
| InChIKey | YIWWMXAOIRPJOI-UHFFFAOYSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ec436i0gzqA |
|---|---|
| Name | 1,3-Benzenediol, o-(3-methylbut-2-enoyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.078644243 u |
| Formula | C11H12O3 |
| InChI | InChI=1S/C11H12O3/c1-8(2)6-11(13)14-10-5-3-4-9(12)7-10/h3-7,12H,1-2H3 |
| InChIKey | YIWWMXAOIRPJOI-UHFFFAOYSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | C1(=CC(=CC=C1)O)OC(C=C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.872904 |