SpectraBase Spectrum ID |
JpTJcgfiHvq |
Name |
Resorcinol, chlorodifluoroacetate, trifluoroacetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.971827120 u |
Formula |
C10H4ClF5O4 |
InChI |
InChI=1S/C10H4ClF5O4/c11-9(12,13)7(17)19-5-2-1-3-6(4-5)20-8(18)10(14,15)16/h1-4H |
InChIKey |
FWNKQNSAWNZVPY-UHFFFAOYSA-N |
Molecular Weight |
318.583 g/mol |
SMILES |
C1=C(C=CC=C1OC(C(F)(F)Cl)=O)OC(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923727 |