| SpectraBase Spectrum ID |
BVQKperawPx |
| Name |
cis-Cyclohex-4-en-1,2-dicarboxylic acid, 4-chloro-3-methylphenyl isobutyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.128486917 u |
| Formula |
C19H23ClO4 |
| InChI |
InChI=1S/C19H23ClO4/c1-12(2)11-23-18(21)15-6-4-5-7-16(15)19(22)24-14-8-9-17(20)13(3)10-14/h4-5,8-10,12,15-16H,6-7,11H2,1-3H3 |
| InChIKey |
ROZBGGLNLVTSSA-UHFFFAOYSA-N |
| Molecular Weight |
350.842 g/mol |
| SMILES |
C=1CC(C(CC1)C(OCC(C)C)=O)C(=O)OC=1C=CC(=C(C)C1)Cl |
