SpectraBase Spectrum ID |
Ba5qzK31xI0 |
Name |
4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane, heptafluorobutyrate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.070206036 u |
Formula |
C11H13F7O4 |
InChI |
InChI=1S/C11H13F7O4/c1-8(2)21-5-6(22-8)3-4-20-7(19)9(12,13)10(14,15)11(16,17)18/h6H,3-5H2,1-2H3 |
InChIKey |
ZZXJVQYHRYNXQA-UHFFFAOYSA-N |
Molecular Weight |
342.210 g/mol |
SMILES |
C1OC(C)(C)OC1CCOC(=O)C(C(C(F)(F)F)(F)F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947967 |