| SpectraBase Compound ID | I7iSF8aWzzQ |
|---|---|
| InChI | InChI=1S/C12H10O3/c1-8(13)6-10-7-9-4-2-3-5-11(9)15-12(10)14/h2-5,7H,6H2,1H3 |
| InChIKey | DKBZNUVHFQBCPD-UHFFFAOYSA-N |
| Mol Weight | 202.21 g/mol |
| Molecular Formula | C12H10O3 |
| Exact Mass | 202.062994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | dt9kzZArMP |
|---|---|
| Name | 3-(2-Oxopropyl)-2H-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.062994179 u |
| Formula | C12H10O3 |
| InChI | InChI=1S/C12H10O3/c1-8(13)6-10-7-9-4-2-3-5-11(9)15-12(10)14/h2-5,7H,6H2,1H3 |
| InChIKey | DKBZNUVHFQBCPD-UHFFFAOYSA-N |
| Molecular Weight | 202.209 g/mol |
| SMILES | C=1(C(OC2=C(C1)C=CC=C2)=O)CC(=O)C |