| SpectraBase Compound ID | 9EwwJ2VVs4N |
|---|---|
| InChI | InChI=1S/C16H23F2NOS/c1-2-3-4-5-6-10-13-19-15(20)16(17,18)21-14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3,(H,19,20) |
| InChIKey | XSNPKNNQVIFCOO-UHFFFAOYSA-N |
| Mol Weight | 315.42 g/mol |
| Molecular Formula | C16H23F2NOS |
| Exact Mass | 315.146842 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6FBl0vFuYMP |
|---|---|
| Name | 2,2-bis(Fluoranyl)-N-octyl-2-phenylsulfanyl-ethanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.146841864 u |
| Formula | C16H23F2NOS |
| InChI | InChI=1S/C16H23F2NOS/c1-2-3-4-5-6-10-13-19-15(20)16(17,18)21-14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3,(H,19,20) |
| InChIKey | XSNPKNNQVIFCOO-UHFFFAOYSA-N |
| Molecular Weight | 315.423 g/mol |
| SMILES | C(C(SC=1C=CC=CC1)(F)F)(=O)NCCCCCCCC |