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Methyl 1-(5-tert-butyl-1H-pyrazol-3-yl)-2-(4-chlorophenyl)-1H-benzo[d]imidazole-5-carboxylate
SpectraBase Compound ID 8eWLvp3Db4A
InChI InChI=1S/C22H21ClN4O2/c1-22(2,3)18-12-19(26-25-18)27-17-10-7-14(21(28)29-4)11-16(17)24-20(27)13-5-8-15(23)9-6-13/h5-12H,1-4H3,(H,25,26)
InChIKey QBXSFEQYLUYSMX-UHFFFAOYSA-N
Mol Weight 408.89 g/mol
Molecular Formula C22H21ClN4O2
Exact Mass 408.135304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0nLSKt6g6w
Name Methyl 1-(5-tert-butyl-1H-pyrazol-3-yl)-2-(4-chlorophenyl)-1H-benzo[d]imidazole-5-carboxylate
Alternate Name(s) 1-(5-tert-butyl-1H-pyrazol-3-yl)-2-(4-chlorophenyl)-5-benzimidazolecarboxylic acid methyl ester Methyl 1-(5-tert-butyl-1H-pyrazol-3-yl)-2-(4-chlorophenyl)benzimidazole-5-carboxylate
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Formula C22H21ClN4O2
InChI InChI=1S/C22H21ClN4O2/c1-22(2,3)18-12-19(26-25-18)27-17-10-7-14(21(28)29-4)11-16(17)24-20(27)13-5-8-15(23)9-6-13/h5-12H,1-4H3,(H,25,26)
InChIKey QBXSFEQYLUYSMX-UHFFFAOYSA-N
Molecular Weight 408.889 g/mol
SMILES [nH]1c(cc(n1)-[n]1c(nc2c1ccc(C(=O)OC)c2)-c1ccc(cc1)Cl)C(C)(C)C
SPLASH splash10-0a4i-0007900000-9cb7606726edb075ee42
Source of Spectrum F2-46-4066-11b
Wiley ID 1689962