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5-(1-Ethoxycarbonyl-ethyl)-2-methyl-1-ureido-1H-pyrrole-3-carboxylic acid ethyl ester
SpectraBase Compound ID 7QXrPvCXYAF
InChI InChI=1S/C14H21N3O5/c1-5-21-12(18)8(3)11-7-10(13(19)22-6-2)9(4)17(11)16-14(15)20/h7-8H,5-6H2,1-4H3,(H3,15,16,20)
InChIKey LQKLAXNPRVTWQB-UHFFFAOYSA-N
Mol Weight 311.34 g/mol
Molecular Formula C14H21N3O5
Exact Mass 311.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vNavm8PMQ8
Name 5-(1-Ethoxycarbonyl-ethyl)-2-methyl-1-ureido-1H-pyrrole-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21N3O5
InChI InChI=1S/C14H21N3O5/c1-5-21-12(18)8(3)11-7-10(13(19)22-6-2)9(4)17(11)16-14(15)20/h7-8H,5-6H2,1-4H3,(H3,15,16,20)
InChIKey LQKLAXNPRVTWQB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800097
Molecular Weight 311.338 g/mol
SMILES N(C(=O)N)[n]1c(c(cc1C(C)C(=O)OCC)C(=O)OCC)C
SPLASH splash10-000i-0391000000-cf7f99b4efd127a02054
Source of Spectrum ASC-350-1331/SM24-3ao
Synonyms Ethyl 5-(1-ethoxy-1-oxopropan-2-yl)-2-methyl-1-ureido-1H-pyrrole-3-carboxylate
Wiley ID 1766354