![2-(1-{[4-(Trifluoromethyl)phenyl]methyl}-1,2,3-triazol-4-yl)ethanamine](/api/spectrum/Eng6uKodDQv/structure.png?h=300&w=458 "2-(1-{[4-(Trifluoromethyl)phenyl]methyl}-1,2,3-triazol-4-yl)ethanamine")
| SpectraBase Compound ID | NR2vhXw6Tt |
|---|---|
| InChI | InChI=1S/C12H13F3N4/c13-12(14,15)10-3-1-9(2-4-10)7-19-8-11(5-6-16)17-18-19/h1-4,8H,5-7,16H2 |
| InChIKey | RPMFURKFXOYCRA-UHFFFAOYSA-N |
| Mol Weight | 270.26 g/mol |
| Molecular Formula | C12H13F3N4 |
| Exact Mass | 270.109231 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eng6uKodDQv |
|---|---|
| Name | 2-(1-{[4-(Trifluoromethyl)phenyl]methyl}-1,2,3-triazol-4-yl)ethanamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.109230924 u |
| Formula | C12H13F3N4 |
| InChI | InChI=1S/C12H13F3N4/c13-12(14,15)10-3-1-9(2-4-10)7-19-8-11(5-6-16)17-18-19/h1-4,8H,5-7,16H2 |
| InChIKey | RPMFURKFXOYCRA-UHFFFAOYSA-N |
| Molecular Weight | 270.259 g/mol |
| SMILES | C=1N(CC2=CC=C(C=C2)C(F)(F)F)N=NC1CCN |