| SpectraBase Compound ID | 1HgLfqvJNlD |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-12(2)6-9(14)7-4-8(13)11(15-3)5-10(7)16-12/h4-5,13H,6H2,1-3H3 |
| InChIKey | LKLJXWDGEQKJPN-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DdXUKyt2gzs |
|---|---|
| Name | 6-Hydroxy-7-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.089208927 u |
| Formula | C12H14O4 |
| InChI | InChI=1S/C12H14O4/c1-12(2)6-9(14)7-4-8(13)11(15-3)5-10(7)16-12/h4-5,13H,6H2,1-3H3 |
| InChIKey | LKLJXWDGEQKJPN-UHFFFAOYSA-N |
| Molecular Weight | 222.240 g/mol |
| SMILES | C=12C(OC(CC2=O)(C)C)=CC(=C(C1)O)OC |