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4-[[2-furanylmethyl-(4-methylphenyl)sulfonylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID DWEGwJFtyHg
InChI InChI=1S/C22H26N2O5S/c1-5-28-22(25)21-16(3)20(17(4)23-21)14-24(13-18-7-6-12-29-18)30(26,27)19-10-8-15(2)9-11-19/h6-12,23H,5,13-14H2,1-4H3
InChIKey XGNOXKVIIKPGIR-UHFFFAOYSA-N
Mol Weight 430.52 g/mol
Molecular Formula C22H26N2O5S
Exact Mass 430.156243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YvJhpcO36
Name 4-[[2-furanylmethyl-(4-methylphenyl)sulfonylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
Alternate Name(s) 4-[[2-furfuryl(tosyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-[[2-furylmethyl(p-tolylsulfonyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Ethyl 4-[[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O5S
InChI InChI=1S/C22H26N2O5S/c1-5-28-22(25)21-16(3)20(17(4)23-21)14-24(13-18-7-6-12-29-18)30(26,27)19-10-8-15(2)9-11-19/h6-12,23H,5,13-14H2,1-4H3
InChIKey XGNOXKVIIKPGIR-UHFFFAOYSA-N
Molecular Weight 430.519 g/mol
SMILES CCOC(c1c(c(CN(S(c2ccc(cc2)C)(=O)=O)Cc2occc2)c([nH]1)C)C)=O
SPLASH splash10-001i-4900000000-f405e085146c2cbbfc2d
Wiley ID 1442180