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1-BENZYL-5-(DIMETHYLAMINO)-2-(METHYLTHIO)-3,4-BIS-(METHOXYCARBONYL)-PYRROLE

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

1-BENZYL-5-(DIMETHYLAMINO)-2-(METHYLTHIO)-3,4-BIS-(METHOXYCARBONYL)-PYRROLE
SpectraBase Compound ID 53pz9HtYAos
InChI InChI=1S/C18H22N2O4S/c1-19(2)15-13(17(21)23-3)14(18(22)24-4)16(25-5)20(15)11-12-9-7-6-8-10-12/h6-10H,11H2,1-5H3
InChIKey JLOIQJPPHCVODY-UHFFFAOYSA-N
Mol Weight 362.44 g/mol
Molecular Formula C18H22N2O4S
Exact Mass 362.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73liPSnteCy
Name 1-Benzyl-2-(dimethylamino)-5-(methylthio)pyrrole-3,4-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O4S
InChI InChI=1S/C18H22N2O4S/c1-19(2)15-13(17(21)23-3)14(18(22)24-4)16(25-5)20(15)11-12-9-7-6-8-10-12/h6-10H,11H2,1-5H3
InChIKey JLOIQJPPHCVODY-UHFFFAOYSA-N
Molecular Weight 362.444 g/mol
SMILES c1(c(c(SC)[n](c1N(C)C)Cc1ccccc1)C(=O)OC)C(=O)OC
SPLASH splash10-00di-1091000000-239c7207da3e08d10604
Source of Spectrum J-58-6028-8
Synonyms 2-(dimethylamino)-5-(methylthio)-1-(phenylmethyl)pyrrole-3,4-dicarboxylic acid dimethyl ester Dimethyl 1-benzyl-2-(dimethylamino)-5-methylsulfanyl-pyrrole-3,4-dicarboxylate Dimethyl 2-(dimethylamino)-5-methylsulfanyl-1-(phenylmethyl)pyrrole-3,4-dicarboxylate
Wiley ID 1349449