| SpectraBase Spectrum ID |
7xquO5BvO2j |
| Name |
2-Hydroxy-2',4',6'-trichlorobiphenyl, pentafluoropropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.935353346 u |
| Formula |
C15H6Cl3F5O2 |
| InChI |
InChI=1S/C15H6Cl3F5O2/c16-7-5-9(17)12(10(18)6-7)8-3-1-2-4-11(8)25-13(24)14(19,20)15(21,22)23/h1-6H |
| InChIKey |
OMVZAYSPGNKIIK-UHFFFAOYSA-N |
| Molecular Weight |
419.562 g/mol |
| SMILES |
C1(C2=C(C=C(C=C2Cl)Cl)Cl)=C(C=CC=C1)OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857982 |
