![2-(trifluoroacetyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole](/api/spectrum/8HhixU0rB5I/structure.png?h=300&w=458 "2-(trifluoroacetyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole")
| SpectraBase Compound ID | 6B3FCrSzsno |
|---|---|
| InChI | InChI=1S/C13H11F3N2O/c14-13(15,16)12(19)18-6-5-11-9(7-18)8-3-1-2-4-10(8)17-11/h1-4,17H,5-7H2 |
| InChIKey | RLCXDXCCNYCGRZ-UHFFFAOYSA-N |
| Mol Weight | 268.24 g/mol |
| Molecular Formula | C13H11F3N2O |
| Exact Mass | 268.082347 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8HhixU0rB5I |
|---|---|
| Name | 2-(Trifluoroacetyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-B]indole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.082347470 u |
| Formula | C13H11F3N2O |
| InChI | InChI=1S/C13H11F3N2O/c14-13(15,16)12(19)18-6-5-11-9(7-18)8-3-1-2-4-10(8)17-11/h1-4,17H,5-7H2 |
| InChIKey | RLCXDXCCNYCGRZ-UHFFFAOYSA-N |
| Molecular Weight | 268.239 g/mol |
| SMILES | N1C=2C(C3=C1CCN(C3)C(C(F)(F)F)=O)=CC=CC2 |