| SpectraBase Compound ID | EfpVYr7JRYM |
|---|---|
| InChI | InChI=1S/C11H10O3/c1-6-3-4-8-7(2)5-9(12)14-11(8)10(6)13/h3-5,13H,1-2H3 |
| InChIKey | CKKORNGRGZYMOB-UHFFFAOYSA-N |
| Mol Weight | 190.2 g/mol |
| Molecular Formula | C11H10O3 |
| Exact Mass | 190.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KTvuSthMRKI |
|---|---|
| Name | 4,7-Dimethyl-8-oxidanyl-chromen-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.062994179 u |
| Formula | C11H10O3 |
| InChI | InChI=1S/C11H10O3/c1-6-3-4-8-7(2)5-9(12)14-11(8)10(6)13/h3-5,13H,1-2H3 |
| InChIKey | CKKORNGRGZYMOB-UHFFFAOYSA-N |
| Molecular Weight | 190.198 g/mol |
| SMILES | C=12C(C(C)=CC(O2)=O)=CC=C(C1O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.872335 |