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Dimethyl 2-(4-methoxybenzoyl)-5-(4-methylanilino)-3,4-thiophenedicarboxylate
SpectraBase Compound ID o7xJ3RQpa8
InChI InChI=1S/C23H21NO6S/c1-13-5-9-15(10-6-13)24-21-18(23(27)30-4)17(22(26)29-3)20(31-21)19(25)14-7-11-16(28-2)12-8-14/h5-12,24H,1-4H3
InChIKey QPMPQBSHFXEYIC-UHFFFAOYSA-N
Mol Weight 439.48 g/mol
Molecular Formula C23H21NO6S
Exact Mass 439.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBJu6DyqdWW
Name Dimethyl 2-(4-methoxybenzoyl)-5-(4-methylanilino)-3,4-thiophenedicarboxylate
Appearance White powders
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21NO6S
InChI InChI=1S/C23H21NO6S/c1-13-5-9-15(10-6-13)24-21-18(23(27)30-4)17(22(26)29-3)20(31-21)19(25)14-7-11-16(28-2)12-8-14/h5-12,24H,1-4H3
InChIKey QPMPQBSHFXEYIC-UHFFFAOYSA-N
Instrument Name FINNIGAN-MAT 8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3884
Molecular Weight 439.482 g/mol
SMILES N(c1sc(c(C(OC)=O)c1C(=O)OC)C(c1ccc(cc1)OC)=O)c1ccc(cc1)C
SPLASH splash10-053r-9000700000-e6007627cb02bcdcb29f
Source of Spectrum Y-57-1595-5c
Wiley ID 1860138