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

*Links on SpectraBase are not permalinks.
Diglycolic acid, butyl 4-chlorophenyl ester
SpectraBase Compound ID 9ikgumvLCWk
InChI InChI=1S/C14H17ClO5/c1-2-3-8-19-13(16)9-18-10-14(17)20-12-6-4-11(15)5-7-12/h4-7H,2-3,8-10H2,1H3
InChIKey FJZDSKIKYXSISH-UHFFFAOYSA-N
Mol Weight 300.74 g/mol
Molecular Formula C14H17ClO5
Exact Mass 300.076451 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 5VGDGIwuOxI
Name Diglycolic acid, butyl 4-chlorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.076451342 u
Formula C14H17ClO5
InChI InChI=1S/C14H17ClO5/c1-2-3-8-19-13(16)9-18-10-14(17)20-12-6-4-11(15)5-7-12/h4-7H,2-3,8-10H2,1H3
InChIKey FJZDSKIKYXSISH-UHFFFAOYSA-N
SMILES C(COCC(=O)OCCCC)(=O)OC1=CC=C(C=C1)Cl