| SpectraBase Spectrum ID |
AZ0TJcgBlma |
| Name |
1,2-Cyclohexanedicarboxylic acid, 4-chloro-2-methylphenyl ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.112836852 u |
| Formula |
C17H21ClO4 |
| InChI |
InChI=1S/C17H21ClO4/c1-3-21-16(19)13-6-4-5-7-14(13)17(20)22-15-9-8-12(18)10-11(15)2/h8-10,13-14H,3-7H2,1-2H3 |
| InChIKey |
GRWFKACOLDDLBX-UHFFFAOYSA-N |
| Molecular Weight |
324.804 g/mol |
| SMILES |
C(C1CCCCC1C(OCC)=O)(=O)OC=1C(C)=CC(=CC1)Cl |
