| SpectraBase Compound ID | 9HWGDkrMdfr |
|---|---|
| InChI | InChI=1S/C14H14F7NO2/c1-8(7-9-3-5-10(24-2)6-4-9)22-11(23)12(15,16)13(17,18)14(19,20)21/h3-6,8H,7H2,1-2H3,(H,22,23) |
| InChIKey | NHEGEKGXBFQHBP-UHFFFAOYSA-N |
| Mol Weight | 361.26 g/mol |
| Molecular Formula | C14H14F7NO2 |
| Exact Mass | 361.091276 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | mhfqRsqTpq |
|---|---|
| Name | (.+/-.)-p-methoxyamphetamine, N-heptafluorobutyryl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 361.091275834 u |
| Formula | C14H14F7NO2 |
| InChI | InChI=1S/C14H14F7NO2/c1-8(7-9-3-5-10(24-2)6-4-9)22-11(23)12(15,16)13(17,18)14(19,20)21/h3-6,8H,7H2,1-2H3,(H,22,23) |
| InChIKey | NHEGEKGXBFQHBP-UHFFFAOYSA-N |
| Molecular Weight | 361.260 g/mol |
| SMILES | C1=CC(=CC=C1CC(NC(=O)C(C(C(F)(F)F)(F)F)(F)F)C)OC |