| SpectraBase Compound ID | 1pazH4zzwSl |
|---|---|
| InChI | InChI=1S/C10H8ClF3O2/c1-6(16-9(15)10(11,13)14)7-2-4-8(12)5-3-7/h2-6H,1H3 |
| InChIKey | AFVNSMAGCIJSLZ-UHFFFAOYSA-N |
| Mol Weight | 252.62 g/mol |
| Molecular Formula | C10H8ClF3O2 |
| Exact Mass | 252.016492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6pzZZCMkWsp |
|---|---|
| Name | 4-Fluoro-.alpha.-methylbenzyl alcohol, chlorodifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.016491685 u |
| Formula | C10H8ClF3O2 |
| InChI | InChI=1S/C10H8ClF3O2/c1-6(16-9(15)10(11,13)14)7-2-4-8(12)5-3-7/h2-6H,1H3 |
| InChIKey | AFVNSMAGCIJSLZ-UHFFFAOYSA-N |
| Molecular Weight | 252.620 g/mol |
| SMILES | C1(=CC=C(C=C1)F)C(OC(C(F)(F)Cl)=O)C |