SpectraBase Spectrum ID |
6oanFDE6szG |
Name |
Glutaric acid, hexa-1,5-dien-3-yl 2,3-dichlorophenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
356.058214456 u |
Formula |
C17H18Cl2O4 |
InChI |
InChI=1S/C17H18Cl2O4/c1-3-7-12(4-2)22-15(20)10-6-11-16(21)23-14-9-5-8-13(18)17(14)19/h3-5,8-9,12H,1-2,6-7,10-11H2 |
InChIKey |
LJDKWWGEZLJZHU-UHFFFAOYSA-N |
Molecular Weight |
357.233 g/mol |
SMILES |
C(CCC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OC(C=C)CC=C)=O |