| SpectraBase Compound ID | 5NyRhPQPiZ9 |
|---|---|
| InChI | InChI=1S/C24H26F15NO/c1-2-3-4-5-6-7-11-14-40(15-16-12-9-8-10-13-16)17(41)18(25,26)19(27,28)20(29,30)21(31,32)22(33,34)23(35,36)24(37,38)39/h8-10,12-13H,2-7,11,14-15H2,1H3 |
| InChIKey | KPAOHPWHVTVAGC-UHFFFAOYSA-N |
| Mol Weight | 629.45 g/mol |
| Molecular Formula | C24H26F15NO |
| Exact Mass | 629.177487 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J22Ylj7meLa |
|---|---|
| Name | Pentadecafluorooctanoylamide, N-benzyl-N-nonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 629.177486905 u |
| Formula | C24H26F15NO |
| InChI | InChI=1S/C24H26F15NO/c1-2-3-4-5-6-7-11-14-40(15-16-12-9-8-10-13-16)17(41)18(25,26)19(27,28)20(29,30)21(31,32)22(33,34)23(35,36)24(37,38)39/h8-10,12-13H,2-7,11,14-15H2,1H3 |
| InChIKey | KPAOHPWHVTVAGC-UHFFFAOYSA-N |
| Molecular Weight | 629.454 g/mol |
| SMILES | C1=CC=C(C=C1)CN(C(=O)C(C(F)(F)C(C(F)(F)C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)CCCCCCCCC |