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

*Links on SpectraBase are not permalinks.

1,2-Dibutyl 4,5-diethyl benzene-1,2,4,5-tetracarboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,2-Dibutyl 4,5-diethyl benzene-1,2,4,5-tetracarboxylate
SpectraBase Compound ID BPVflmYQ8gI
InChI InChI=1S/C22H30O8/c1-5-9-11-29-21(25)17-13-15(19(23)27-7-3)16(20(24)28-8-4)14-18(17)22(26)30-12-10-6-2/h13-14H,5-12H2,1-4H3
InChIKey QNGNFIZGSAOEIA-UHFFFAOYSA-N
Mol Weight 422.47 g/mol
Molecular Formula C22H30O8
Exact Mass 422.194068 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 55wOPaeZUZu
Name 1,2-Dibutyl 4,5-diethyl benzene-1,2,4,5-tetracarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.194067918 u
Formula C22H30O8
InChI InChI=1S/C22H30O8/c1-5-9-11-29-21(25)17-13-15(19(23)27-7-3)16(20(24)28-8-4)14-18(17)22(26)30-12-10-6-2/h13-14H,5-12H2,1-4H3
InChIKey QNGNFIZGSAOEIA-UHFFFAOYSA-N
Molecular Weight 422.474 g/mol
SMILES C=1(C(=O)OCC)C=C(C(=CC1C(=O)OCC)C(=O)OCCCC)C(=O)OCCCC