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1-BENZYL-5-(4-FLUOROPHENYL)-1H-[1,2,3]-TRIAZOLE-4-CARBONITRILE
SpectraBase Compound ID 2vd7MbH6vb9
InChI InChI=1S/C16H11FN4/c17-14-8-6-13(7-9-14)16-15(10-18)19-20-21(16)11-12-4-2-1-3-5-12/h1-9H,11H2
InChIKey YNQLRNWHBHPBIF-UHFFFAOYSA-N
Mol Weight 278.29 g/mol
Molecular Formula C16H11FN4
Exact Mass 278.096775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Yae8pIYK7p
Name 1-Benzyl-5-(4'-fluorophenyl)-3H-(1,2,3)-triazole-4-carbonitrile
Alternate Name(s) 1-Benzyl-5-(4-fluorophenyl)-1H-1,2,3-triazole-4-carbonitrile 5-(4-fluorophenyl)-1-(phenylmethyl)-4-triazolecarbonitrile 5-(4-fluorophenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carbonitrile
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Formula C16H11FN4
InChI InChI=1S/C16H11FN4/c17-14-8-6-13(7-9-14)16-15(10-18)19-20-21(16)11-12-4-2-1-3-5-12/h1-9H,11H2
InChIKey YNQLRNWHBHPBIF-UHFFFAOYSA-N
Molecular Weight 278.290 g/mol
SMILES c1(nn[n](c1-c1ccc(cc1)F)Cc1ccccc1)C#N
SPLASH splash10-0006-9060000000-033a2fa8c0274e7b4195
Source of Spectrum AJ-43-677-4
Wiley ID 1594095