| SpectraBase Spectrum ID |
19FLxGuBfMg |
| Name |
2-Phenylamino-3,5,6-trifluoro-p-benzoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
253.035062924 u |
| Formula |
C12H6F3NO2 |
| InChI |
InChI=1S/C12H6F3NO2/c13-7-8(14)12(18)10(9(15)11(7)17)16-6-4-2-1-3-5-6/h1-5,16H |
| InChIKey |
JEDFEEPILIGZDB-UHFFFAOYSA-N |
| Molecular Weight |
253.180 g/mol |
| SMILES |
C1(=C(C(=O)C(=C(C1=O)F)F)F)NC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953434 |
