| SpectraBase Compound ID | 6z0t8KADEsv |
|---|---|
| InChI | InChI=1S/C16H18F7NO/c1-2-3-7-10-24(11-12-8-5-4-6-9-12)13(25)14(17,18)15(19,20)16(21,22)23/h4-6,8-9H,2-3,7,10-11H2,1H3 |
| InChIKey | XWAVAIVKAAZNLN-UHFFFAOYSA-N |
| Mol Weight | 373.31 g/mol |
| Molecular Formula | C16H18F7NO |
| Exact Mass | 373.127661 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | INmm4UWGG2m |
|---|---|
| Name | Heptafluorobutyramide, N-benzyl-N-pentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 373.127661344 u |
| Formula | C16H18F7NO |
| InChI | InChI=1S/C16H18F7NO/c1-2-3-7-10-24(11-12-8-5-4-6-9-12)13(25)14(17,18)15(19,20)16(21,22)23/h4-6,8-9H,2-3,7,10-11H2,1H3 |
| InChIKey | XWAVAIVKAAZNLN-UHFFFAOYSA-N |
| Molecular Weight | 373.315 g/mol |
| SMILES | C(N(CCCCC)CC1=CC=CC=C1)(=O)C(C(C(F)(F)F)(F)F)(F)F |