| SpectraBase Compound ID | HikgAYgsVNS |
|---|---|
| InChI | InChI=1S/C13H16F3N3O/c14-13(15,16)12(20)18-11-3-6-19(7-4-11)9-10-2-1-5-17-8-10/h1-2,5,8,11H,3-4,6-7,9H2,(H,18,20) |
| InChIKey | QFRVOZYWXWFOCY-UHFFFAOYSA-N |
| Mol Weight | 287.29 g/mol |
| Molecular Formula | C13H16F3N3O |
| Exact Mass | 287.124547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bq5XAK7bwK8 |
|---|---|
| Name | 1-(3-Pyridinylmethyl)-4-piperidinamine, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.124546635 u |
| Formula | C13H16F3N3O |
| InChI | InChI=1S/C13H16F3N3O/c14-13(15,16)12(20)18-11-3-6-19(7-4-11)9-10-2-1-5-17-8-10/h1-2,5,8,11H,3-4,6-7,9H2,(H,18,20) |
| InChIKey | QFRVOZYWXWFOCY-UHFFFAOYSA-N |
| Molecular Weight | 287.286 g/mol |
| SMILES | C1N(CCC(C1)NC(C(F)(F)F)=O)CC1=CN=CC=C1 |