| SpectraBase Spectrum ID |
HhoNkLjvWcr |
| Name |
Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4,4-trimethylpentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.170493770 u |
| Formula |
C15H25F3O4 |
| InChI |
InChI=1S/C15H25F3O4/c1-10(8-14(3,4)5)9-21-12(19)6-7-13(20)22-11(2)15(16,17)18/h10-11H,6-9H2,1-5H3 |
| InChIKey |
LKFDDPTVCISPQJ-UHFFFAOYSA-N |
| Molecular Weight |
326.356 g/mol |
| SMILES |
C(CC(OC(C)C(F)(F)F)=O)C(OCC(C)CC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9829 |
