| SpectraBase Compound ID | Cppt7C4oJcm |
|---|---|
| InChI | InChI=1S/C18H25F4NO/c1-3-5-7-12-23(13-8-6-4-2)17(24)14-10-9-11-15(16(14)19)18(20,21)22/h9-11H,3-8,12-13H2,1-2H3 |
| InChIKey | ACWHJPUSCDJFGN-UHFFFAOYSA-N |
| Mol Weight | 347.4 g/mol |
| Molecular Formula | C18H25F4NO |
| Exact Mass | 347.187227 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1qlaa6FsooE |
|---|---|
| Name | Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-pentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.187227080 u |
| Formula | C18H25F4NO |
| InChI | InChI=1S/C18H25F4NO/c1-3-5-7-12-23(13-8-6-4-2)17(24)14-10-9-11-15(16(14)19)18(20,21)22/h9-11H,3-8,12-13H2,1-2H3 |
| InChIKey | ACWHJPUSCDJFGN-UHFFFAOYSA-N |
| Molecular Weight | 347.398 g/mol |
| SMILES | C1=CC=C(C(=C1C(=O)N(CCCCC)CCCCC)F)C(F)(F)F |