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4-Chloro-5-phenyl-3-p-tolyl-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

4-Chloro-5-phenyl-3-p-tolyl-1H-pyrazole
SpectraBase Compound ID GD8owefYRPy
InChI InChI=1S/C16H13ClN2/c1-11-7-9-13(10-8-11)16-14(17)15(18-19-16)12-5-3-2-4-6-12/h2-10H,1H3,(H,18,19)
InChIKey LOCVVJSXXCHFJX-UHFFFAOYSA-N
Mol Weight 268.75 g/mol
Molecular Formula C16H13ClN2
Exact Mass 268.076726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VvCEbaPYHx
Name 4-Chloro-5-phenyl-3-p-tolyl-1H-pyrazole
Alternate Name(s) 4-Chloro-5-phenyl-3-(p-tolyl)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN2
InChI InChI=1S/C16H13ClN2/c1-11-7-9-13(10-8-11)16-14(17)15(18-19-16)12-5-3-2-4-6-12/h2-10H,1H3,(H,18,19)
InChIKey LOCVVJSXXCHFJX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol2004947
Molecular Weight 268.747 g/mol
SMILES [nH]1c(c(c(n1)-c1ccc(cc1)C)Cl)-c1ccccc1
SPLASH splash10-014i-2190000000-1c0c0a20c9bb4d04cec0
Source of Spectrum A1-13-2082/SMSI4-2b
Wiley ID 1753141