SpectraBase Spectrum ID |
Faof4jdG9f0 |
Name |
Diethyl-meso-3,3-dimethylcyclopropane-1,2-dicarboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.120509056 u |
Formula |
C11H18O4 |
InChI |
InChI=1S/C11H18O4/c1-5-14-9(12)7-8(11(7,3)4)10(13)15-6-2/h7-8H,5-6H2,1-4H3/t7-,8+ |
InChIKey |
MPRMNWDIYNBXRC-OCAPTIKFSA-N |
Molecular Weight |
214.261 g/mol |
SMILES |
C(=O)([C@@]1(C([C@@]1(C(=O)OCC)[H])(C)C)[H])OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940625 |