| SpectraBase Compound ID | LdT0yh7UJ3h |
|---|---|
| InChI | InChI=1S/C16H11ClF2O4/c1-9(17)15(20)22-12-7-2-3-8-13(12)23-16(21)14-10(18)5-4-6-11(14)19/h2-9H,1H3 |
| InChIKey | HAHPOAWHUSPSKF-UHFFFAOYSA-N |
| Mol Weight | 340.71 g/mol |
| Molecular Formula | C16H11ClF2O4 |
| Exact Mass | 340.031393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBqvVNwAcK4 |
|---|---|
| Name | 1,2-Benzenediol, o-(2-chloropropionyl)-o'-(2,6-difluorobenzoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.031392856 u |
| Formula | C16H11ClF2O4 |
| InChI | InChI=1S/C16H11ClF2O4/c1-9(17)15(20)22-12-7-2-3-8-13(12)23-16(21)14-10(18)5-4-6-11(14)19/h2-9H,1H3 |
| InChIKey | HAHPOAWHUSPSKF-UHFFFAOYSA-N |
| Molecular Weight | 340.710 g/mol |
| SMILES | C1=CC(=C(C(=C1)F)C(OC=1C(=CC=CC1)OC(C(Cl)C)=O)=O)F |