| SpectraBase Compound ID | 9hPzjHg89pT |
|---|---|
| InChI | InChI=1S/C13H14ClF3N2O/c1-9-2-3-10(14)8-11(9)18-4-6-19(7-5-18)12(20)13(15,16)17/h2-3,8H,4-7H2,1H3 |
| InChIKey | BRESDPYWUBBSCK-UHFFFAOYSA-N |
| Mol Weight | 306.72 g/mol |
| Molecular Formula | C13H14ClF3N2O |
| Exact Mass | 306.074675 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EY78sey7II1 |
|---|---|
| Name | 1-(5-Chloro-2-methylphenyl)piperazine, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.074675267 u |
| Formula | C13H14ClF3N2O |
| InChI | InChI=1S/C13H14ClF3N2O/c1-9-2-3-10(14)8-11(9)18-4-6-19(7-5-18)12(20)13(15,16)17/h2-3,8H,4-7H2,1H3 |
| InChIKey | BRESDPYWUBBSCK-UHFFFAOYSA-N |
| Molecular Weight | 306.716 g/mol |
| SMILES | C1(Cl)=CC(=C(C=C1)C)N1CCN(CC1)C(C(F)(F)F)=O |