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(TRANS)-1,4-(4-CHLOROBUTYL)-1,4-DIHYDRONAPHTHALENE-1,4-DICARBOXYLIC-ACID
SpectraBase Compound ID D81qIJtI4Ff
InChI InChI=1S/C20H24Cl2O4/c21-13-5-3-9-19(17(23)24)11-12-20(18(25)26,10-4-6-14-22)16-8-2-1-7-15(16)19/h1-2,7-8,11-12H,3-6,9-10,13-14H2,(H,23,24)(H,25,26)/t19-,20-/m0/s1
InChIKey VNIHHHIFNAHURI-PMACEKPBSA-N
Mol Weight 399.31 g/mol
Molecular Formula C20H24Cl2O4
Exact Mass 398.105165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H78ZpypP8Pe
Name (TRANS)-1,4-(4-CHLOROBUTYL)-1,4-DIHYDRONAPHTHALENE-1,4-DICARBOXYLIC-ACID
Compound Number 16G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24Cl2O4
InChI InChI=1S/C20H24Cl2O4/c21-13-5-3-9-19(17(23)24)11-12-20(18(25)26,10-4-6-14-22)16-8-2-1-7-15(16)19/h1-2,7-8,11-12H,3-6,9-10,13-14H2,(H,23,24)(H,25,26)/t19-,20-/m0/s1
InChIKey VNIHHHIFNAHURI-PMACEKPBSA-N
Literature Reference Author A.BRAMBORG,T.LINKER
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5552(2012)
Literature Reference DOI 10.1002/ejoc.201200823
Molecular Weight 399.314 g/mol
Solvent CD3OD
Source File Reference UWLU83575