![acetamide, 2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-](/api/spectrum/KqgcMIHyos4/structure.png?h=300&w=458 "acetamide, 2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-")
| SpectraBase Compound ID | HdrvY71uqP0 |
|---|---|
| InChI | InChI=1S/C13H13NO4/c1-7-8(2)13(16)18-11-5-9(3-4-10(7)11)17-6-12(14)15/h3-5H,6H2,1-2H3,(H2,14,15) |
| InChIKey | OCSKQRLBHOIHSP-UHFFFAOYSA-N |
| Mol Weight | 247.25 g/mol |
| Molecular Formula | C13H13NO4 |
| Exact Mass | 247.084458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KqgcMIHyos4 |
|---|---|
| Name | Acetamide, 2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.084457899 u |
| Formula | C13H13NO4 |
| InChI | InChI=1S/C13H13NO4/c1-7-8(2)13(16)18-11-5-9(3-4-10(7)11)17-6-12(14)15/h3-5H,6H2,1-2H3,(H2,14,15) |
| InChIKey | OCSKQRLBHOIHSP-UHFFFAOYSA-N |
| Molecular Weight | 247.250 g/mol |
| SMILES | NC(COC=1C=C2OC(C(=C(C)C2=CC1)C)=O)=O |