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3-Cyanomethyl-5-(3'-bromophenyl)pyrazole
SpectraBase Compound ID 2NPTW8wsSA2
InChI InChI=1S/C11H8BrN3/c12-9-3-1-2-8(6-9)11-7-10(4-5-13)14-15-11/h1-3,6-7H,4H2,(H,14,15)
InChIKey RNJJKHRXHOULEM-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 BgrXsqWVH9p
Name 3-Cyanomethyl-5-(3'-bromophenyl)pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8BrN3
InChI InChI=1S/C11H8BrN3/c12-9-3-1-2-8(6-9)11-7-10(4-5-13)14-15-11/h1-3,6-7H,4H2,(H,14,15)
InChIKey RNJJKHRXHOULEM-UHFFFAOYSA-N
Molecular Weight 262.110 g/mol
SMILES [nH]1nc(cc1-c1cc(Br)ccc1)CC#N
SPLASH splash10-03di-0190000000-51677b1d6342627c034d
Source of Spectrum Y1-36-876-20
Synonyms [5-(3-bromophenyl)-1H-pyrazol-3-yl]acetonitrile
Wiley ID 1527134