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Dimethyl 2-diethylamino-5-methyl-6-methylthiobiphenyl-3,4-dicarboxylate
SpectraBase Compound ID BdEHngXpCN6
InChI InChI=1S/C22H27NO4S/c1-7-23(8-2)19-17(15-12-10-9-11-13-15)20(28-6)14(3)16(21(24)26-4)18(19)22(25)27-5/h9-13H,7-8H2,1-6H3
InChIKey YCKCTYZJBORJSC-UHFFFAOYSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76wtcwNUohc
Name Dimethyl 2-diethylamino-5-methyl-6-methylthiobiphenyl-3,4-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO4S
InChI InChI=1S/C22H27NO4S/c1-7-23(8-2)19-17(15-12-10-9-11-13-15)20(28-6)14(3)16(21(24)26-4)18(19)22(25)27-5/h9-13H,7-8H2,1-6H3
InChIKey YCKCTYZJBORJSC-UHFFFAOYSA-N
Molecular Weight 401.521 g/mol
SMILES c1(c(c(C)c(c(c1N(CC)CC)-c1ccccc1)SC)C(=O)OC)C(=O)OC
SPLASH splash10-0f79-0009200000-11e4884816fa4ad32591
Source of Spectrum QE-2-954-22
Synonyms Dimethyl 2-(diethylamino)-5-methyl-6-(methylsulfanyl)[1,1'-biphenyl]-3,4-dicarboxylate Dimethyl 4-diethylamino-5-methyl-6-methylthiobiphenyl-3,4-dicarboxylate 3-(diethylamino)-6-methyl-5-(methylthio)-4-phenylbenzene-1,2-dicarboxylic acid dimethyl ester Dimethyl 3-(diethylamino)-6-methyl-5-methylsulfanyl-4-phenylbenzene-1,2-dicarboxylate Dimethyl 3-(diethylamino)-6-methyl-5-methylsulfanyl-4-phenyl-benzene-1,2-dicarboxylate
Wiley ID 842597