SpectraBase Spectrum ID |
3fMCujBagVr |
Name |
Dimethyl 2-carbethoxy-cyclopropane-1,1-dicarboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
230.079038165 u |
Formula |
C10H14O6 |
InChI |
InChI=1S/C10H14O6/c1-4-16-7(11)6-5-10(6,8(12)14-2)9(13)15-3/h6H,4-5H2,1-3H3 |
InChIKey |
DRKBUXUCVALQMJ-UHFFFAOYSA-N |
Molecular Weight |
230.216 g/mol |
SMILES |
C(OC)(C1(C(OC)=O)C(C(OCC)=O)C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833109 |