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4-(2-Bromo-4,5-dimethoxyphenyl)-5-(2-iodophenyl)-1-phenylpyrazole

View entire compound with spectra: 1 MS (GC)

4-(2-Bromo-4,5-dimethoxyphenyl)-5-(2-iodophenyl)-1-phenylpyrazole
SpectraBase Compound ID FnQdL09w9lQ
InChI InChI=1S/C23H18BrIN2O2/c1-28-21-12-17(19(24)13-22(21)29-2)18-14-26-27(15-8-4-3-5-9-15)23(18)16-10-6-7-11-20(16)25/h3-14H,1-2H3
InChIKey IREAYVKZOCJQNJ-UHFFFAOYSA-N
Mol Weight 561.22 g/mol
Molecular Formula C23H18BrIN2O2
Exact Mass 559.959636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ErfRWU3bit
Name 4-(2-Bromo-4,5-dimethoxyphenyl)-5-(2-iodophenyl)-1-phenylpyrazole
Alternate Name(s) 4-(2-bromo-4,5-dimethoxyphenyl)-5-(2-iodophenyl)-1-phenyl-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18BrIN2O2
InChI InChI=1S/C23H18BrIN2O2/c1-28-21-12-17(19(24)13-22(21)29-2)18-14-26-27(15-8-4-3-5-9-15)23(18)16-10-6-7-11-20(16)25/h3-14H,1-2H3
InChIKey IREAYVKZOCJQNJ-UHFFFAOYSA-N
Molecular Weight 561.217 g/mol
SMILES c1n[n](c(c1-c1c(cc(c(c1)OC)OC)Br)-c1c(cccc1)I)-c1ccccc1
SPLASH splash10-0ik9-0007190000-83e4607fd3c86d162b2a
Source of Spectrum J-65-7017-2
Wiley ID 1533438