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5-Ethoxycarbonylmethyl-2-methyl-1-ureido-1H-pyrrole-3-carboxylic acid ethyl ester
SpectraBase Compound ID DFAy9Vyrw6N
InChI InChI=1S/C13H19N3O5/c1-4-20-11(17)7-9-6-10(12(18)21-5-2)8(3)16(9)15-13(14)19/h6H,4-5,7H2,1-3H3,(H3,14,15,19)
InChIKey WCSGNDPILXKUQB-UHFFFAOYSA-N
Mol Weight 297.31 g/mol
Molecular Formula C13H19N3O5
Exact Mass 297.132471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HecaXHWi837
Name 5-Ethoxycarbonylmethyl-2-methyl-1-ureido-1H-pyrrole-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19N3O5
InChI InChI=1S/C13H19N3O5/c1-4-20-11(17)7-9-6-10(12(18)21-5-2)8(3)16(9)15-13(14)19/h6H,4-5,7H2,1-3H3,(H3,14,15,19)
InChIKey WCSGNDPILXKUQB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800097
Molecular Weight 297.311 g/mol
SMILES N(C(=O)N)[n]1c(c(cc1CC(=O)OCC)C(=O)OCC)C
SPLASH splash10-05a9-0390000000-42a06d0666bee8919660
Source of Spectrum ASC-350-1331/SM3-3b
Synonyms Ethyl 5-(2-ethoxy-2-oxoethyl)-2-methyl-1-ureido-1H-pyrrole-3-carboxylate
Wiley ID 1766359