| SpectraBase Spectrum ID |
DOLIbT52YCD |
| Name |
Succinic acid, 3-methylbut-2-yl 2,2,3,3,3-pentafluoropropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.104699838 u |
| Formula |
C12H17F5O4 |
| InChI |
InChI=1S/C12H17F5O4/c1-7(2)8(3)21-10(19)5-4-9(18)20-6-11(13,14)12(15,16)17/h7-8H,4-6H2,1-3H3 |
| InChIKey |
BPTZAEMSNFQMBZ-UHFFFAOYSA-N |
| Molecular Weight |
320.256 g/mol |
| SMILES |
C(CC(OC(C(C)C)C)=O)C(OCC(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940964 |
