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4-[2-(5-O-Tolyl-tetrazol-2-yl)-acetylamino]-benzoic acid ethyl ester
SpectraBase Compound ID 9xAGTxi7PHM
InChI InChI=1S/C19H19N5O3/c1-3-27-19(26)14-8-10-15(11-9-14)20-17(25)12-24-22-18(21-23-24)16-7-5-4-6-13(16)2/h4-11H,3,12H2,1-2H3,(H,20,25)
InChIKey KIQUVMAZPLWNDI-UHFFFAOYSA-N
Mol Weight 365.39 g/mol
Molecular Formula C19H19N5O3
Exact Mass 365.148789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BsAC0zflB
Name 4-[2-(5-O-Tolyl-tetrazol-2-yl)-acetylamino]-benzoic acid ethyl ester
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Formula C19H19N5O3
InChI InChI=1S/C19H19N5O3/c1-3-27-19(26)14-8-10-15(11-9-14)20-17(25)12-24-22-18(21-23-24)16-7-5-4-6-13(16)2/h4-11H,3,12H2,1-2H3,(H,20,25)
InChIKey KIQUVMAZPLWNDI-UHFFFAOYSA-N
Molecular Weight 365.393 g/mol
SMILES N(C(C[n]1nc(nn1)-c1c(C)cccc1)=O)c1ccc(C(=O)OCC)cc1
SPLASH splash10-00kb-2900000000-0a503347d83194a932c6
Synonyms 4-[[2-[5-(2-methylphenyl)-2-tetrazolyl]-1-oxoethyl]amino]benzoic acid ethyl ester Ethyl 4-(([5-(2-methylphenyl)-2H-tetraazol-2-yl]acetyl)amino)benzoate Ethyl 4-[2-[5-(2-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoylamino]benzoate Ethyl 4-[[2-[5-(2-methylphenyl)tetrazol-2-yl]acetyl]amino]benzoate Ethyl 4-[[2-[5-(o-tolyl)tetrazol-2-yl]acetyl]amino]benzoate
Wiley ID 1461481