| SpectraBase Spectrum ID |
5HLQ9OsZiS |
| Name |
3,5-Bis-(trifluoromethyl)benzonitrile |
| Appearance |
Clear, yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
239.016968079 u |
| Formula |
C9H3F6N |
| InChI |
InChI=1S/C9H3F6N/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-3H |
| InChIKey |
CZKHHAOIHXHOSR-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600549 |
| Molecular Weight |
239.120 g/mol |
| Quality |
334 |
| SMILES |
C=1C(=CC(=CC1C(F)(F)F)C#N)C(F)(F)F |
| SPLASH |
splash10-00dr-2690000000-fd560c51680f1462bf31 |
| Source of Spectrum |
QE-22-SM7-Table 2, entry 6 (DOI: 10.1002/chem.201600549) |
| Wiley ID |
1903103 |
