SpectraBase Spectrum ID |
3x6Ow5IF4YK |
Name |
Cyclopropanecarboxylic acid, 2,2-dichloro-3-methyl-, ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
196.005784960 u |
Formula |
C7H10Cl2O2 |
InChI |
InChI=1S/C7H10Cl2O2/c1-3-11-6(10)5-4(2)7(5,8)9/h4-5H,3H2,1-2H3 |
InChIKey |
GJGBGWKYCZVYRL-UHFFFAOYSA-N |
Molecular Weight |
197.061 g/mol |
SMILES |
C1(C(C(=O)OCC)C1C)(Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931231 |