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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzUiCuKFBkV
Name 1,2-Dibutyl 4,5-diethyl benzene-1,2,4,5-tetracarboxylate
Alternate Name(s) 1-O,2-O-dibutyl 4-O,5-O-diethyl benzene-1,2,4,5-tetracarboxylate O1,O2-dibutyl O4,O5-diethyl benzene-1,2,4,5-tetracarboxylate
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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
Literature Reference DOI 10.1021/jo101554r
Molecular Weight 422.474 g/mol
SMILES c1(C(=O)OCC)cc(c(cc1C(=O)OCC)C(=O)OCCCC)C(=O)OCCCC
SPLASH splash10-0036-9062000000-4d85b3aa276d5548dbe0
Source of Spectrum J-75-8279/SM6-4he
Wiley ID 1751804