| SpectraBase Compound ID | IEjB9nUHmxN |
|---|---|
| InChI | InChI=1S/C9H10O4/c1-6(10)5-12-8-3-7(2)13-9(11)4-8/h3-4H,5H2,1-2H3 |
| InChIKey | MOFGOIGUSXCNQR-UHFFFAOYSA-N |
| Mol Weight | 182.17 g/mol |
| Molecular Formula | C9H10O4 |
| Exact Mass | 182.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F77lerywIS2 |
|---|---|
| Name | 6-Methyl-4-(2-oxopropyloxy)-2H-pyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.057908798 u |
| Formula | C9H10O4 |
| InChI | InChI=1S/C9H10O4/c1-6(10)5-12-8-3-7(2)13-9(11)4-8/h3-4H,5H2,1-2H3 |
| InChIKey | MOFGOIGUSXCNQR-UHFFFAOYSA-N |
| Molecular Weight | 182.175 g/mol |
| SMILES | C1(OC(=CC(=C1)OCC(C)=O)C)=O |