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1-Methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID 1h0f1LyQZrN
InChI InChI=1S/C19H20N6O6/c1-22-8-11(20-18(27)15-7-13(25(29)30)10-24(15)3)5-14(22)17(26)21-12-6-16(19(28)31-4)23(2)9-12/h5-10H,1-4H3,(H,20,27)(H,21,26)
InChIKey WMAKIRPXFQIRJN-UHFFFAOYSA-N
Mol Weight 428.41 g/mol
Molecular Formula C19H20N6O6
Exact Mass 428.144432 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ez2mzg5f0je
Name 1-Methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxylic acid methyl ester
CAS Registry Number 69910-21-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N6O6
InChI InChI=1S/C19H20N6O6/c1-22-8-11(20-18(27)15-7-13(25(29)30)10-24(15)3)5-14(22)17(26)21-12-6-16(19(28)31-4)23(2)9-12/h5-10H,1-4H3,(H,20,27)(H,21,26)
InChIKey WMAKIRPXFQIRJN-UHFFFAOYSA-N
Molecular Weight 428.405 g/mol
SMILES N(c1cc(C(Nc2cc(C(=O)OC)[n](c2)C)=O)[n](c1)C)C(c1cc(N(=O)=O)c[n]1C)=O
SPLASH splash10-004i-0092500000-07bc0a924472d5e1e978
Source of Spectrum F-34-2390-0
Synonyms 1-Methyl-4-[[[1-methyl-4-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]-2-pyrrolecarboxylic acid methyl ester Methyl 1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]pyrrole-2-carboxylate Methyl 1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxylate Methyl 1-methyl-4-{[(1-methyl-4-{[(1-methyl-4-nitro-1H-pyrrol-2-yl)carbonyl]amino}-1H-pyrrol-2-yl)carbonyl]amino}-1H-pyrrole-2-carboxylate
Wiley ID 1380562