| SpectraBase Spectrum ID |
DkDEehRZ8fb |
| Name |
Succinic acid, 2-pentyl 2,2,3,3-tetrafluoropropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.114121708 u |
| Formula |
C12H18F4O4 |
| InChI |
InChI=1S/C12H18F4O4/c1-3-4-8(2)20-10(18)6-5-9(17)19-7-12(15,16)11(13)14/h8,11H,3-7H2,1-2H3 |
| InChIKey |
SIQPRDOKHPCHJE-UHFFFAOYSA-N |
| Molecular Weight |
302.266 g/mol |
| SMILES |
C(OCC(C(F)F)(F)F)(=O)CCC(OC(C)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827729 |
