| SpectraBase Compound ID | 9UbV4axaFsb |
|---|---|
| InChI | InChI=1S/C10H8F5NO/c1-2-3-16-10(17)4-5(11)7(13)9(15)8(14)6(4)12/h2-3H2,1H3,(H,16,17) |
| InChIKey | NLSLFMICFKMAFS-UHFFFAOYSA-N |
| Mol Weight | 253.17 g/mol |
| Molecular Formula | C10H8F5NO |
| Exact Mass | 253.052605 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EbB39BvP8p |
|---|---|
| Name | Pentafluorobenzenecarboxamide, N-propyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.052604696 u |
| Formula | C10H8F5NO |
| InChI | InChI=1S/C10H8F5NO/c1-2-3-16-10(17)4-5(11)7(13)9(15)8(14)6(4)12/h2-3H2,1H3,(H,16,17) |
| InChIKey | NLSLFMICFKMAFS-UHFFFAOYSA-N |
| Molecular Weight | 253.172 g/mol |
| SMILES | C1(F)=C(F)C(F)=C(F)C(=C1C(=O)NCCC)F |