![3,4-dimethyl-7-[(3-methyl-2-butenyl)oxy]-2H-chromen-2-one](/api/spectrum/AQLGCqBKHKN/structure.png?h=300&w=458 "3,4-dimethyl-7-[(3-methyl-2-butenyl)oxy]-2H-chromen-2-one")
| SpectraBase Compound ID | 6e032p7bVTe |
|---|---|
| InChI | InChI=1S/C16H18O3/c1-10(2)7-8-18-13-5-6-14-11(3)12(4)16(17)19-15(14)9-13/h5-7,9H,8H2,1-4H3 |
| InChIKey | JPXNBDJQCQURSE-UHFFFAOYSA-N |
| Mol Weight | 258.32 g/mol |
| Molecular Formula | C16H18O3 |
| Exact Mass | 258.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AQLGCqBKHKN |
|---|---|
| Name | 3,4-Dimethyl-7-[(3-methyl-2-butenyl)oxy]-2H-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.125594437 u |
| Formula | C16H18O3 |
| InChI | InChI=1S/C16H18O3/c1-10(2)7-8-18-13-5-6-14-11(3)12(4)16(17)19-15(14)9-13/h5-7,9H,8H2,1-4H3 |
| InChIKey | JPXNBDJQCQURSE-UHFFFAOYSA-N |
| Molecular Weight | 258.317 g/mol |
| SMILES | C1(C(=C(C)C=2C(O1)=CC(=CC2)OCC=C(C)C)C)=O |