| SpectraBase Spectrum ID |
Jthhw7xPSeA |
| Name |
Phenyl 3',5'-bis(trifluoromethyl)-[1,1'-biphenyl]-4-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
410.074148602 u |
| Formula |
C21H12F6O2 |
| InChI |
InChI=1S/C21H12F6O2/c22-20(23,24)16-10-15(11-17(12-16)21(25,26)27)13-6-8-14(9-7-13)19(28)29-18-4-2-1-3-5-18/h1-12H |
| InChIKey |
UDJAGWWPGMZRLW-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201611819 |
| Molecular Weight |
410.315 g/mol |
| SMILES |
C1(=CC=CC=C1)OC(=O)C1=CC=C(C=C1)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
| SPLASH |
splash10-014i-0039000000-0bb2104f64583f18b6ec |
| Source of Spectrum |
ACI-56-SM3-1h (DOI: 10.1002/anie.201611819) |
| Wiley ID |
1895596 |
![Phenyl 3',5'-bis(trifluoromethyl)-[1,1'-biphenyl]-4-carboxylate](/api/spectrum/Jthhw7xPSeA/structure.png?h=300&w=458 "Phenyl 3',5'-bis(trifluoromethyl)-[1,1'-biphenyl]-4-carboxylate")
