| SpectraBase Spectrum ID |
24XV3NjDjPv |
| Name |
Pyrogallol, tris(pentafluoropropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
563.969010256 u |
| Formula |
C15H3F15O6 |
| InChI |
InChI=1S/C15H3F15O6/c16-10(17,13(22,23)24)7(31)34-4-2-1-3-5(35-8(32)11(18,19)14(25,26)27)6(4)36-9(33)12(20,21)15(28,29)30/h1-3H |
| InChIKey |
LTEIEOOUEFMQRH-UHFFFAOYSA-N |
| Molecular Weight |
564.159 g/mol |
| SMILES |
C1(=C(C=CC=C1OC(C(C(F)(F)F)(F)F)=O)OC(C(C(F)(F)F)(F)F)=O)OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924463 |
