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1-Benzyl-5-(2',4'-difluorophenyl)-3H-(1,2,3)-triazole-4-carbonitrile
SpectraBase Compound ID 31YR2xHbj2K
InChI InChI=1S/C16H10F2N4/c17-12-6-7-13(14(18)8-12)16-15(9-19)20-21-22(16)10-11-4-2-1-3-5-11/h1-8H,10H2
InChIKey HFLAFTROAKOUEB-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C16H10F2N4
Exact Mass 296.087353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BltVIeJPnkI
Name 1-Benzyl-5-(2',4'-difluorophenyl)-3H-(1,2,3)-triazole-4-carbonitrile
Alternate Name(s) 1-Benzyl-5-(2,4-difluorophenyl)-1H-1,2,3-triazole-4-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10F2N4
InChI InChI=1S/C16H10F2N4/c17-12-6-7-13(14(18)8-12)16-15(9-19)20-21-22(16)10-11-4-2-1-3-5-11/h1-8H,10H2
InChIKey HFLAFTROAKOUEB-UHFFFAOYSA-N
Molecular Weight 296.281 g/mol
SMILES c1([n](nnc1C#N)Cc1ccccc1)-c1c(cc(cc1)F)F
SPLASH splash10-0006-9010000000-8ab0f3aff77152a7aea9
Source of Spectrum AJ-43-677-4
Wiley ID 1594094