| SpectraBase Compound ID | EVAY2qUPhpA |
|---|---|
| InChI | InChI=1S/C14H14F7NO/c1-11(2,3)8-4-6-9(7-5-8)22-10(23)12(15,16)13(17,18)14(19,20)21/h4-7H,1-3H3,(H,22,23) |
| InChIKey | SFERHNSUZRWJGA-UHFFFAOYSA-N |
| Mol Weight | 345.26 g/mol |
| Molecular Formula | C14H14F7NO |
| Exact Mass | 345.096361 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BqIxPPAb2ql |
|---|---|
| Name | 4-Tert-butylaniline, N-heptafluorobutyryl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 345.096361215 u |
| Formula | C14H14F7NO |
| InChI | InChI=1S/C14H14F7NO/c1-11(2,3)8-4-6-9(7-5-8)22-10(23)12(15,16)13(17,18)14(19,20)21/h4-7H,1-3H3,(H,22,23) |
| InChIKey | SFERHNSUZRWJGA-UHFFFAOYSA-N |
| Molecular Weight | 345.261 g/mol |
| SMILES | C(C)(C)(C)C1=CC=C(C=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F |