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5-(2-Iodophenyl)-1,4-diphenylpyrazole
SpectraBase Compound ID HuBSp83i0j
InChI InChI=1S/C21H15IN2/c22-20-14-8-7-13-18(20)21-19(16-9-3-1-4-10-16)15-23-24(21)17-11-5-2-6-12-17/h1-15H
InChIKey TVJAKRQKTBMOPR-UHFFFAOYSA-N
Mol Weight 422.27 g/mol
Molecular Formula C21H15IN2
Exact Mass 422.027993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4g8uIqhgfr6
Name 5-(2-Iodophenyl)-1,4-diphenylpyrazole
Alternate Name(s) 5-(2-iodanylphenyl)-1,4-diphenyl-pyrazole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15IN2
InChI InChI=1S/C21H15IN2/c22-20-14-8-7-13-18(20)21-19(16-9-3-1-4-10-16)15-23-24(21)17-11-5-2-6-12-17/h1-15H
InChIKey TVJAKRQKTBMOPR-UHFFFAOYSA-N
Molecular Weight 422.269 g/mol
SMILES c1n[n](c(c1-c1ccccc1)-c1c(cccc1)I)-c1ccccc1
SPLASH splash10-00dj-0050900000-3ccde4133e1144ce50c2
Source of Spectrum J-65-7018-8
Wiley ID 1533434