| SpectraBase Spectrum ID |
Ke7U6AYIwyq |
| Name |
Succinic acid, 3-chlorophenyl 2,2,3,4,4,4-hexafluorobutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.025005508 u |
| Formula |
C14H11ClF6O4 |
| InChI |
InChI=1S/C14H11ClF6O4/c15-8-2-1-3-9(6-8)25-11(23)5-4-10(22)24-7-13(17,18)12(16)14(19,20)21/h1-3,6,12H,4-5,7H2 |
| InChIKey |
FVYYZPUSRCHDOB-UHFFFAOYSA-N |
| Molecular Weight |
392.681 g/mol |
| SMILES |
C(CC(OC1=CC(=CC=C1)Cl)=O)C(OCC(C(C(F)(F)F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847328 |
