For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Glutaric acid, 2,3-dichlorophenyl 4-methylpent-2-yl ester
SpectraBase Compound ID JoGycgjtPx7
InChI InChI=1S/C17H22Cl2O4/c1-11(2)10-12(3)22-15(20)8-5-9-16(21)23-14-7-4-6-13(18)17(14)19/h4,6-7,11-12H,5,8-10H2,1-3H3
InChIKey DXYCDSIZXJBXIY-UHFFFAOYSA-N
Mol Weight 361.27 g/mol
Molecular Formula C17H22Cl2O4
Exact Mass 360.089515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 63plrrEp5ec
Name Glutaric acid, 2,3-dichlorophenyl 4-methylpent-2-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.089514584 u
Formula C17H22Cl2O4
InChI InChI=1S/C17H22Cl2O4/c1-11(2)10-12(3)22-15(20)8-5-9-16(21)23-14-7-4-6-13(18)17(14)19/h4,6-7,11-12H,5,8-10H2,1-3H3
InChIKey DXYCDSIZXJBXIY-UHFFFAOYSA-N
Molecular Weight 361.265 g/mol
SMILES C(CCC(OC(C)CC(C)C)=O)C(OC1=CC=CC(=C1Cl)Cl)=O