SpectraBase Spectrum ID |
1hv3kAW81EF |
Name |
Cyclohexane, 1,1-ethylenedioxy-2-(2-methyl-1-propenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
196.146329882 u |
Formula |
C12H20O2 |
InChI |
InChI=1S/C12H20O2/c1-10(2)9-11-5-3-4-6-12(11)13-7-8-14-12/h9,11H,3-8H2,1-2H3 |
InChIKey |
IUWGJCDGWHNPOO-UHFFFAOYSA-N |
Molecular Weight |
196.290 g/mol |
SMILES |
C1CCC(C2(C1)OCCO2)C=C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893421 |