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

*Links on SpectraBase are not permalinks.
Succinic acid, dec-2-yl 4-chloro-2-methoxyphenyl ester
SpectraBase Compound ID CurVI8hquQA
InChI InChI=1S/C21H31ClO5/c1-4-5-6-7-8-9-10-16(2)26-20(23)13-14-21(24)27-18-12-11-17(22)15-19(18)25-3/h11-12,15-16H,4-10,13-14H2,1-3H3
InChIKey QGDBHFJCLWWOKX-UHFFFAOYSA-N
Mol Weight 398.93 g/mol
Molecular Formula C21H31ClO5
Exact Mass 398.186002 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 L7mAuRYaTRk
Name Succinic acid, dec-2-yl 4-chloro-2-methoxyphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.186001793 u
Formula C21H31ClO5
InChI InChI=1S/C21H31ClO5/c1-4-5-6-7-8-9-10-16(2)26-20(23)13-14-21(24)27-18-12-11-17(22)15-19(18)25-3/h11-12,15-16H,4-10,13-14H2,1-3H3
InChIKey QGDBHFJCLWWOKX-UHFFFAOYSA-N
Molecular Weight 398.927 g/mol
SMILES C(CC(OC(C)CCCCCCCC)=O)C(OC1=C(C=C(C=C1)Cl)OC)=O