| SpectraBase Compound ID | 7CcBI16ymbS |
|---|---|
| InChI | InChI=1S/C9H14BrClF2O2/c10-6-4-2-1-3-5-7-15-8(14)9(11,12)13/h1-7H2 |
| InChIKey | BHEGXDUPLKVMPM-UHFFFAOYSA-N |
| Mol Weight | 307.56 g/mol |
| Molecular Formula | C9H14BrClF2O2 |
| Exact Mass | 305.983377 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3OV7FUBQ53L |
|---|---|
| Name | 7-Bromo-1-heptanol, chlorodifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.983376715 u |
| Formula | C9H14BrClF2O2 |
| InChI | InChI=1S/C9H14BrClF2O2/c10-6-4-2-1-3-5-7-15-8(14)9(11,12)13/h1-7H2 |
| InChIKey | BHEGXDUPLKVMPM-UHFFFAOYSA-N |
| Molecular Weight | 307.563 g/mol |
| SMILES | C(Br)CCCCCCOC(C(F)(F)Cl)=O |