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2-[3-(4-bromophenyl)-1H-pyrazol-5-yl]acetonitrile
SpectraBase Compound ID 9N72l9iVKTQ
InChI InChI=1S/C11H8BrN3/c12-9-3-1-8(2-4-9)11-7-10(5-6-13)14-15-11/h1-4,7H,5H2,(H,14,15)
InChIKey LONGYNYRAPHNDS-UHFFFAOYSA-N
Mol Weight 262.11 g/mol
Molecular Formula C11H8BrN3
Exact Mass 260.99016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJAzZOXAutj
Name 2-[3-(4-bromophenyl)-1H-pyrazol-5-yl]acetonitrile
Alternate Name(s) [5-(4-Bromophenyl)-1H-pyrazol-3-yl]acetonitrile 2-[3-(4-bromophenyl)-1H-pyrazol-5-yl]ethanenitrile
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Formula C11H8BrN3
InChI InChI=1S/C11H8BrN3/c12-9-3-1-8(2-4-9)11-7-10(5-6-13)14-15-11/h1-4,7H,5H2,(H,14,15)
InChIKey LONGYNYRAPHNDS-UHFFFAOYSA-N
Molecular Weight 262.110 g/mol
SMILES [nH]1c(cc(n1)CC#N)-c1ccc(cc1)Br
SPLASH splash10-03di-1090000000-fd782a939057f2c79ed9
Source of Spectrum Y1-32-927-5
Wiley ID 1526183