SpectraBase Spectrum ID |
CFkTlGY3dFE |
Name |
1,4-Cyclohexanedimethanol vinyl ether, o-acetyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
212.141244501 u |
Formula |
C12H20O3 |
InChI |
InChI=1S/C12H20O3/c1-3-14-8-11-4-6-12(7-5-11)9-15-10(2)13/h3,11-12H,1,4-9H2,2H3 |
InChIKey |
XJDAZERETCDNOX-UHFFFAOYSA-N |
Molecular Weight |
212.289 g/mol |
SMILES |
C=COCC1CCC(COC(C)=O)CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942518 |