| SpectraBase Spectrum ID |
6BpGh5u2eeC |
| Name |
Benzenemethanol, 2,3,4,5,6-pentafluoro-.alpha.,.alpha.-bis(pentafluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
529.978787096 u |
| Formula |
C19HF15O |
| InChI |
InChI=1S/C19HF15O/c20-4-1(5(21)11(27)16(32)10(4)26)19(35,2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25/h35H |
| InChIKey |
DEXNEWGHWDRTJC-UHFFFAOYSA-N |
| Molecular Weight |
530.192 g/mol |
| SMILES |
C(O)(C1=C(F)C(F)=C(C(=C1F)F)F)(C1=C(F)C(F)=C(C(=C1F)F)F)C1=C(F)C(F)=C(C(=C1F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932061 |
