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5-(Bromodifluoromethyl)-3-phenyl-1-o-tolyl-1H-pyrazole
SpectraBase Compound ID Jbek1lvLUvH
InChI InChI=1S/C17H13BrF2N2/c1-12-7-5-6-10-15(12)22-16(17(18,19)20)11-14(21-22)13-8-3-2-4-9-13/h2-11H,1H3
InChIKey MCMKKVOPAFQRPN-UHFFFAOYSA-N
Mol Weight 363.21 g/mol
Molecular Formula C17H13BrF2N2
Exact Mass 362.023018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPOOLtCzbkA
Name 5-(Bromodifluoromethyl)-3-phenyl-1-o-tolyl-1H-pyrazole
Alternate Name(s) 5-(bromodifluoromethyl)-3-phenyl-1-(o-tolyl)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrF2N2
InChI InChI=1S/C17H13BrF2N2/c1-12-7-5-6-10-15(12)22-16(17(18,19)20)11-14(21-22)13-8-3-2-4-9-13/h2-11H,1H3
InChIKey MCMKKVOPAFQRPN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201180442
Molecular Weight 363.206 g/mol
SMILES c1([n](nc(c1)-c1ccccc1)-c1c(cccc1)C)C(F)(F)Br
SPLASH splash10-001i-2091000000-39b341fc97403e162eda
Source of Spectrum CJC-29-2696-3bc
Wiley ID 1772506