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[3-(4-Bromophenyl)-1-phenylpyrazol-5-yl]acetonitrile
SpectraBase Compound ID JSsZwGy3AT6
InChI InChI=1S/C17H12BrN3/c18-14-8-6-13(7-9-14)17-12-16(10-11-19)21(20-17)15-4-2-1-3-5-15/h1-9,12H,10H2
InChIKey NIDIBQDMDUQIFX-UHFFFAOYSA-N
Mol Weight 338.21 g/mol
Molecular Formula C17H12BrN3
Exact Mass 337.02146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xyESga3hA
Name [3-(4-Bromophenyl)-1-phenylpyrazol-5-yl]acetonitrile
Alternate Name(s) [3-(4-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12BrN3
InChI InChI=1S/C17H12BrN3/c18-14-8-6-13(7-9-14)17-12-16(10-11-19)21(20-17)15-4-2-1-3-5-15/h1-9,12H,10H2
InChIKey NIDIBQDMDUQIFX-UHFFFAOYSA-N
Molecular Weight 338.208 g/mol
SMILES C(Cc1[n](nc(c1)-c1ccc(cc1)Br)-c1ccccc1)#N
SPLASH splash10-004i-4921000000-7313731ba1aaa3b16100
Source of Spectrum Y1-32-926-3
Wiley ID 1526063