| SpectraBase Compound ID | 6xysIEH8NUc |
|---|---|
| InChI | InChI=1S/C16H21F4NO/c1-4-5-6-8-11(2)21(3)15(22)12-9-7-10-13(14(12)17)16(18,19)20/h7,9-11H,4-6,8H2,1-3H3 |
| InChIKey | JAVZSBWJSVUSIT-UHFFFAOYSA-N |
| Mol Weight | 319.34 g/mol |
| Molecular Formula | C16H21F4NO |
| Exact Mass | 319.155927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1IDtMgXzPKi |
|---|---|
| Name | Benzamide, 2-fluoro-3-trifluoromethyl-N-methyl-N-(hept-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.155926951 u |
| Formula | C16H21F4NO |
| InChI | InChI=1S/C16H21F4NO/c1-4-5-6-8-11(2)21(3)15(22)12-9-7-10-13(14(12)17)16(18,19)20/h7,9-11H,4-6,8H2,1-3H3 |
| InChIKey | JAVZSBWJSVUSIT-UHFFFAOYSA-N |
| Molecular Weight | 319.344 g/mol |
| SMILES | C1=CC=C(C(=C1C(F)(F)F)F)C(N(C)C(CCCCC)C)=O |