| SpectraBase Compound ID | HBVoWo90w1U |
|---|---|
| InChI | InChI=1S/C13H18F2/c14-13(15)11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10,13H,1-2,4,7-8,11H2 |
| InChIKey | MKYGQIGTWORUAP-UHFFFAOYSA-N |
| Mol Weight | 212.28 g/mol |
| Molecular Formula | C13H18F2 |
| Exact Mass | 212.137657 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IvlnygXXenD |
|---|---|
| Name | 1,1-Difluoro-7-phenylheptane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.137656906 u |
| Formula | C13H18F2 |
| InChI | InChI=1S/C13H18F2/c14-13(15)11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10,13H,1-2,4,7-8,11H2 |
| InChIKey | MKYGQIGTWORUAP-UHFFFAOYSA-N |
| Molecular Weight | 212.284 g/mol |
| SMILES | C(F)(CCCCCCC1=CC=CC=C1)F |