SpectraBase Compound ID | 7vHIqlVcTzH |
---|---|
InChI | InChI=1S/C11H10O3/c1-6-3-4-9-8(5-6)7(2)10(12)11(13)14-9/h3-5,12H,1-2H3 |
InChIKey | DBMFWXKUKGCSDU-UHFFFAOYSA-N |
Mol Weight | 190.2 g/mol |
Molecular Formula | C11H10O3 |
Exact Mass | 190.062994 g/mol |
SpectraBase Spectrum ID | JWVKSOPDcvB |
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Name | 3-Hydroxy-4,6-dimethyl-2H-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/c1-6-3-4-9-8(5-6)7(2)10(12)11(13)14-9/h3-5,12H,1-2H3 |
InChIKey | DBMFWXKUKGCSDU-UHFFFAOYSA-N |
Molecular Weight | 190.198 g/mol |
SMILES | C1(=C(C(=O)OC=2C1=CC(=CC2)C)O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.829226 |