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3-(4-Bromophenyl)-1-(4-chlorophenyl)-5-cyanomethylpyrazole

View entire compound with spectra: 2 MS (GC)

3-(4-Bromophenyl)-1-(4-chlorophenyl)-5-cyanomethylpyrazole
SpectraBase Compound ID 7vXjenivclL
InChI InChI=1S/C17H11BrClN3/c18-13-3-1-12(2-4-13)17-11-16(9-10-20)22(21-17)15-7-5-14(19)6-8-15/h1-8,11H,9H2
InChIKey KKGVVNZKAIQVPK-UHFFFAOYSA-N
Mol Weight 372.65 g/mol
Molecular Formula C17H11BrClN3
Exact Mass 370.982488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MwlpYQaL6
Name 3-(4-Bromophenyl)-1-(4-chlorophenyl)-5-cyanomethylpyrazole
Alternate Name(s) [3-(4-bromophenyl)-1-(4-chlorophenyl)-1H-pyrazol-5-yl]acetonitrile 2-(3-(4-bromophenyl)-1-(4-chlorophenyl)-1H-pyrazol-5-yl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11BrClN3
InChI InChI=1S/C17H11BrClN3/c18-13-3-1-12(2-4-13)17-11-16(9-10-20)22(21-17)15-7-5-14(19)6-8-15/h1-8,11H,9H2
InChIKey KKGVVNZKAIQVPK-UHFFFAOYSA-N
Molecular Weight 372.653 g/mol
SMILES c1(cc(-c2ccc(cc2)Br)n[n]1-c1ccc(cc1)Cl)CC#N
SPLASH splash10-00fr-0109000000-37608c8d4b85d18756cb
Source of Spectrum Y1-41B-364-18
Wiley ID 1744127