SpectraBase Spectrum ID |
NsewKNMH9c |
Name |
4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane, trifluoroacetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
242.076593384 u |
Formula |
C9H13F3O4 |
InChI |
InChI=1S/C9H13F3O4/c1-8(2)15-5-6(16-8)3-4-14-7(13)9(10,11)12/h6H,3-5H2,1-2H3 |
InChIKey |
GAOCREWUXCKNJT-UHFFFAOYSA-N |
Molecular Weight |
242.194 g/mol |
SMILES |
C1OC(C)(C)OC1CCOC(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96258 |