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

*Links on SpectraBase are not permalinks.

Succinic acid, 3-methylbut-2-yl pentachlorophenyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3-methylbut-2-yl pentachlorophenyl ester
SpectraBase Compound ID 2IARPa8Q6Iu
InChI InChI=1S/C15H15Cl5O4/c1-6(2)7(3)23-8(21)4-5-9(22)24-15-13(19)11(17)10(16)12(18)14(15)20/h6-7H,4-5H2,1-3H3
InChIKey OKMHWKLWJBPDRX-UHFFFAOYSA-N
Mol Weight 436.5 g/mol
Molecular Formula C15H15Cl5O4
Exact Mass 433.941297 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 FkINY744Iye
Name Succinic acid, 3-methylbut-2-yl pentachlorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.941297459 u
Formula C15H15Cl5O4
InChI InChI=1S/C15H15Cl5O4/c1-6(2)7(3)23-8(21)4-5-9(22)24-15-13(19)11(17)10(16)12(18)14(15)20/h6-7H,4-5H2,1-3H3
InChIKey OKMHWKLWJBPDRX-UHFFFAOYSA-N
Molecular Weight 436.546 g/mol
SMILES C(CC(OC(C(C)C)C)=O)C(OC=1C(=C(C(=C(C1Cl)Cl)Cl)Cl)Cl)=O