| SpectraBase Compound ID | KMVa09BOEmJ |
|---|---|
| InChI | InChI=1S/C14H16O3/c1-4-7-16-10-5-6-11-12(15)9-14(2,3)17-13(11)8-10/h4-6,8H,1,7,9H2,2-3H3 |
| InChIKey | VNGUHTNKUKMDLQ-UHFFFAOYSA-N |
| Mol Weight | 232.28 g/mol |
| Molecular Formula | C14H16O3 |
| Exact Mass | 232.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | hJ1WfQZJms |
|---|---|
| Name | 2,2-Dimethyl-7-prop-2-enoxy-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 | 232.109944372 u |
| Formula | C14H16O3 |
| InChI | InChI=1S/C14H16O3/c1-4-7-16-10-5-6-11-12(15)9-14(2,3)17-13(11)8-10/h4-6,8H,1,7,9H2,2-3H3 |
| InChIKey | VNGUHTNKUKMDLQ-UHFFFAOYSA-N |
| Molecular Weight | 232.279 g/mol |
| SMILES | C1(CC(C=2C=CC(=CC2O1)OCC=C)=O)(C)C |