| SpectraBase Compound ID | 9JTJ80jipA4 |
|---|---|
| InChI | InChI=1S/C11H12O2/c1-7-4-3-5-10-11(7)9(12)6-8(2)13-10/h3-5,8H,6H2,1-2H3 |
| InChIKey | YFUMQFDXKKRKME-UHFFFAOYSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C11H12O2 |
| Exact Mass | 176.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AsZcCfUacgW |
|---|---|
| Name | 4H-1-Benzopyran-4-one, 2,3-dihydro-2,5-dimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.083729624 u |
| Formula | C11H12O2 |
| InChI | InChI=1S/C11H12O2/c1-7-4-3-5-10-11(7)9(12)6-8(2)13-10/h3-5,8H,6H2,1-2H3 |
| InChIKey | YFUMQFDXKKRKME-UHFFFAOYSA-N |
| Molecular Weight | 176.215 g/mol |
| SMILES | C1(=O)C2=C(OC(C1)C)C=CC=C2C |