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4-(2-Iodo-4,5-dimethoxyphenyl)-5-(2-bromophenyl)-1-phenylpyrazole
SpectraBase Compound ID 5xXf994L9uM
InChI InChI=1S/C23H18BrIN2O2/c1-28-21-12-17(20(25)13-22(21)29-2)18-14-26-27(15-8-4-3-5-9-15)23(18)16-10-6-7-11-19(16)24/h3-14H,1-2H3
InChIKey HVQRYGJNVOCEAW-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 9KMJt4l75jw
Name 4-(2-Iodo-4,5-dimethoxyphenyl)-5-(2-bromophenyl)-1-phenylpyrazole
Alternate Name(s) 5-(2-bromophenyl)-4-(2-iodo-4,5-dimethoxyphenyl)-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(20(25)13-22(21)29-2)18-14-26-27(15-8-4-3-5-9-15)23(18)16-10-6-7-11-19(16)24/h3-14H,1-2H3
InChIKey HVQRYGJNVOCEAW-UHFFFAOYSA-N
Molecular Weight 561.217 g/mol
SMILES c1n[n](c(c1-c1c(cc(c(c1)OC)OC)I)-c1c(cccc1)Br)-c1ccccc1
SPLASH splash10-03di-0005190000-bbb4cbbf5b2afbafcd69
Source of Spectrum J-65-7017-2
Wiley ID 1533439