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N-(3-bromanyl-4-methyl-phenyl)-2-[5-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrazol-2-yl]ethanamide
SpectraBase Compound ID C4jbePau8Za
InChI InChI=1S/C17H13BrF3N5O/c1-10-2-7-13(8-14(10)18)22-15(27)9-26-24-16(23-25-26)11-3-5-12(6-4-11)17(19,20)21/h2-8H,9H2,1H3,(H,22,27)
InChIKey OOEJQCVAAXDDGK-UHFFFAOYSA-N
Mol Weight 440.22 g/mol
Molecular Formula C17H13BrF3N5O
Exact Mass 439.025558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhBBYRBvnzB
Name N-(3-bromanyl-4-methyl-phenyl)-2-[5-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrazol-2-yl]ethanamide
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Formula C17H13BrF3N5O
InChI InChI=1S/C17H13BrF3N5O/c1-10-2-7-13(8-14(10)18)22-15(27)9-26-24-16(23-25-26)11-3-5-12(6-4-11)17(19,20)21/h2-8H,9H2,1H3,(H,22,27)
InChIKey OOEJQCVAAXDDGK-UHFFFAOYSA-N
Molecular Weight 440.224 g/mol
SMILES N(c1ccc(c(c1)Br)C)C(=O)C[n]1nnc(-c2ccc(cc2)C(F)(F)F)n1
SPLASH splash10-00dj-4920100000-9990e998ca9bfbd6c9ae
Synonyms N-(3-bromo-4-methyl-phenyl)-2-[5-[4-(trifluoromethyl)phenyl]tetrazol-2-yl]acetamide N-(3-bromo-4-methylphenyl)-2-[5-[4-(trifluoromethyl)phenyl]-2-tetrazolyl]acetamide
Wiley ID 1512396