| SpectraBase Spectrum ID |
LLxcxZj1w5e |
| Name |
4,4'-Dichloro-2,2'-bis(trifluoromethyl)biphenyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.975074571 u |
| Formula |
C14H6Cl2F6 |
| InChI |
InChI=1S/C14H6Cl2F6/c15-7-1-3-9(11(5-7)13(17,18)19)10-4-2-8(16)6-12(10)14(20,21)22/h1-6H |
| InChIKey |
GGFZIJOYLCCPLC-UHFFFAOYSA-N |
| Molecular Weight |
359.098 g/mol |
| SMILES |
C=1(C(=CC(=CC1)Cl)C(F)(F)F)C=1C(=CC(=CC1)Cl)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87206 |
