| SpectraBase Compound ID | HLiEaCXvVok |
|---|---|
| InChI | InChI=1S/C6H4F3N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H2 |
| InChIKey | WRDGNXCXTDDYBZ-UHFFFAOYSA-N |
| Mol Weight | 147.1 g/mol |
| Molecular Formula | C6H4F3N |
| Exact Mass | 147.029584 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | LpJIAwzwQNX |
|---|---|
| Name | 2,3,4-Trifluoroaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.029583622 u |
| Formula | C6H4F3N |
| InChI | InChI=1S/C6H4F3N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H2 |
| InChIKey | WRDGNXCXTDDYBZ-UHFFFAOYSA-N |
| Molecular Weight | 147.100 g/mol |
| SMILES | NC1=CC=C(C(=C1F)F)F |
| Spectrum/Structure Validation Score (Raman) | 0.934354 |