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1-(4-methylphenyl)-2-(1-phenyl-1,2,3,4-tetrazol-5-yl)ethanone
SpectraBase Compound ID BUJJ3BEPyeK
InChI InChI=1S/C16H14N4O/c1-12-7-9-13(10-8-12)15(21)11-16-17-18-19-20(16)14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKey JUYKHLJUDJOTAQ-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C16H14N4O
Exact Mass 278.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fYvxpEB6De
Name 1-(4-methylphenyl)-2-(1-phenyl-1,2,3,4-tetrazol-5-yl)ethanone
Alternate Name(s) 1-(4-methylphenyl)-2-(1-phenyl-1H-tetraazol-5-yl)ethanone 1-(4-methylphenyl)-2-(1-phenyl-5-tetrazolyl)ethanone 1-(4-methylphenyl)-2-(1-phenyltetrazol-5-yl)ethanone 2-(1-phenyltetrazol-5-yl)-1-(p-tolyl)ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C16H14N4O
InChI InChI=1S/C16H14N4O/c1-12-7-9-13(10-8-12)15(21)11-16-17-18-19-20(16)14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKey JUYKHLJUDJOTAQ-UHFFFAOYSA-N
Molecular Weight 278.315 g/mol
SMILES c1(nnn[n]1-c1ccccc1)CC(c1ccc(cc1)C)=O
SPLASH splash10-0udi-0090000000-931a415b4682f008034e
Source of Spectrum SO-0-454-7
Wiley ID 1540019