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1-Phenyl-5-[phenyl(cyano)methyl]tetrazole
SpectraBase Compound ID Lb3EUX30Qud
InChI InChI=1S/C15H11N5/c16-11-14(12-7-3-1-4-8-12)15-17-18-19-20(15)13-9-5-2-6-10-13/h1-10,14H
InChIKey AXCDLFAVUPDCOI-UHFFFAOYSA-N
Mol Weight 261.29 g/mol
Molecular Formula C15H11N5
Exact Mass 261.101445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWxNsEXmJyt
Name 1-Phenyl-5-[phenyl(cyano)methyl]tetrazole
Alternate Name(s) phenyl(1-phenyl-1H-tetraazol-5-yl)acetonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C15H11N5
InChI InChI=1S/C15H11N5/c16-11-14(12-7-3-1-4-8-12)15-17-18-19-20(15)13-9-5-2-6-10-13/h1-10,14H
InChIKey AXCDLFAVUPDCOI-UHFFFAOYSA-N
Molecular Weight 261.288 g/mol
SMILES c1(nnn[n]1-c1ccccc1)C(C#N)c1ccccc1
SPLASH splash10-03f0-0090000000-84ec7f8ea41a612e140b
Source of Spectrum SO-0-454-7
Wiley ID 1540009