| SpectraBase Compound ID | JAxX8ZNnykR |
|---|---|
| InChI | InChI=1S/C11H14F3NO/c1-8(9-5-3-2-4-6-9)15-10(7-16)11(12,13)14/h2-6,8,10,15-16H,7H2,1H3/t8-,10+/m0/s1 |
| InChIKey | WPRAZMSOEFRBNF-WCBMZHEXSA-N |
| Mol Weight | 233.23 g/mol |
| Molecular Formula | C11H14F3NO |
| Exact Mass | 233.102749 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5bUIpzjzYqI |
|---|---|
| Name | (R)-2-((S)-1-Phenylethylamino)-3,3,3-trifluoro-1-propanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.102748563 u |
| Formula | C11H14F3NO |
| InChI | InChI=1S/C11H14F3NO/c1-8(9-5-3-2-4-6-9)15-10(7-16)11(12,13)14/h2-6,8,10,15-16H,7H2,1H3/t8-,10+/m0/s1 |
| InChIKey | WPRAZMSOEFRBNF-WCBMZHEXSA-N |
| Molecular Weight | 233.234 g/mol |
| SMILES | C([C@](N[C@](C1=CC=CC=C1)(C)[H])(CO)[H])(F)(F)F |