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5-(4-Methylphenyl)-1-[4-(1-pyrrolyl)-1,2,5-oxadiazol-3-yl]-4-triazolecarboxylic acid ethyl ester
SpectraBase Compound ID 6ewqEkrXXBM
InChI InChI=1S/C18H16N6O3/c1-3-26-18(25)14-15(13-8-6-12(2)7-9-13)24(22-19-14)17-16(20-27-21-17)23-10-4-5-11-23/h4-11H,3H2,1-2H3
InChIKey DGMCMMWMQVSSRA-UHFFFAOYSA-N
Mol Weight 364.37 g/mol
Molecular Formula C18H16N6O3
Exact Mass 364.128388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5C7AoblQVl5
Name 5-(4-Methylphenyl)-1-[4-(1-pyrrolyl)-1,2,5-oxadiazol-3-yl]-4-triazolecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N6O3
InChI InChI=1S/C18H16N6O3/c1-3-26-18(25)14-15(13-8-6-12(2)7-9-13)24(22-19-14)17-16(20-27-21-17)23-10-4-5-11-23/h4-11H,3H2,1-2H3
InChIKey DGMCMMWMQVSSRA-UHFFFAOYSA-N
Molecular Weight 364.365 g/mol
SMILES c1(nn[n](c1-c1ccc(cc1)C)-c1nonc1-[n]1cccc1)C(OCC)=O
SPLASH splash10-000i-1489000000-74201f52129b0a7bb05b
Synonyms 5-(p-tolyl)-1-(4-pyrrol-1-ylfurazan-3-yl)triazole-4-carboxylic acid ethyl ester Ethyl 5-(4-methylphenyl)-1-(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)-1,2,3-triazole-4-carboxylate Ethyl 5-(4-methylphenyl)-1-(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)triazole-4-carboxylate Ethyl 5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate Ethyl 5-(p-tolyl)-1-(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)triazole-4-carboxylate
Wiley ID 1511706