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4-[[benzyl(esyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID 1Qu4KGl5gI1
InChI InChI=1S/C19H26N2O4S/c1-5-25-19(22)18-14(3)17(15(4)20-18)13-21(26(23,24)6-2)12-16-10-8-7-9-11-16/h7-11,20H,5-6,12-13H2,1-4H3
InChIKey PLHACRGRGSDTAP-UHFFFAOYSA-N
Mol Weight 378.49 g/mol
Molecular Formula C19H26N2O4S
Exact Mass 378.161328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfYysn6kBmv
Name 4-[[benzyl(esyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26N2O4S
InChI InChI=1S/C19H26N2O4S/c1-5-25-19(22)18-14(3)17(15(4)20-18)13-21(26(23,24)6-2)12-16-10-8-7-9-11-16/h7-11,20H,5-6,12-13H2,1-4H3
InChIKey PLHACRGRGSDTAP-UHFFFAOYSA-N
Molecular Weight 378.487 g/mol
SMILES c1(c(c(C(=O)OCC)[nH]c1C)C)CN(S(=O)(=O)CC)Cc1ccccc1
SPLASH splash10-001i-4900000000-df96e676949e415c7419
Synonyms 4-[[ethylsulfonyl-(phenylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-[[benzyl(ethylsulfonyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Ethyl 4-[[ethylsulfonyl-(phenylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1442179