SpectraBase Spectrum ID |
C7Q7HhmwqTi |
Name |
2,2,3,3,3-Pentafluoropropanoic 3-methyl-4-((2,2,3,3,3-pentafluoropropanoyl)oxy)benzoic anhydride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
444.005554918 u |
Formula |
C14H6F10O5 |
InChI |
InChI=1S/C14H6F10O5/c1-5-4-6(8(25)29-10(27)12(17,18)14(22,23)24)2-3-7(5)28-9(26)11(15,16)13(19,20)21/h2-4H,1H3 |
InChIKey |
DXRJODCCOBUORV-UHFFFAOYSA-N |
Molecular Weight |
444.181 g/mol |
SMILES |
C1(=C(C=C(C=C1)C(OC(=O)C(F)(F)C(F)(F)F)=O)C)OC(C(F)(C(F)(F)F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969851 |