4-Phenylenebis[5-(4-bromophenyl)-2'-(2,5':2',5"-terpyrimidine)]

SpectraBase Compound ID	EOFtlT5pynp
InChI	InChI=1S/C42H24Br2N12/c43-35-9-5-25(6-10-35)29-13-45-39(46-14-29)33-21-53-41(54-22-33)31-17-49-37(50-18-31)27-1-2-28(4-3-27)38-51-19-32(20-52-38)42-55-23-34(24-56-42)40-47-15-30(16-48-40)26-7-11-36(44)12-8-26/h1-24H
InChIKey	NZXUOHQTNTZAAA-UHFFFAOYSA-N Google Search
Mol Weight	856.5 g/mol
Molecular Formula	C42H24Br2N12
Exact Mass	854.061365 g/mol

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SpectraBase Spectrum ID	ErXzjopDPlf
Name	4-Phenylenebis[5-(4-bromophenyl)-2'-(2,5':2',5"-terpyrimidine)]
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C42H24Br2N12
InChI	InChI=1S/C42H24Br2N12/c43-35-9-5-25(6-10-35)29-13-45-39(46-14-29)33-21-53-41(54-22-33)31-17-49-37(50-18-31)27-1-2-28(4-3-27)38-51-19-32(20-52-38)42-55-23-34(24-56-42)40-47-15-30(16-48-40)26-7-11-36(44)12-8-26/h1-24H
InChIKey	NZXUOHQTNTZAAA-UHFFFAOYSA-N
Molecular Weight	856.546 g/mol
SMILES	c1(-c2cnc(nc2)-c2cnc(nc2)-c2ccc(-c3ncc(-c4ncc(-c5ncc(cn5)-c5ccc(cc5)Br)cn4)cn3)cc2)ncc(cn1)-c1ccc(cc1)Br
SPLASH	splash10-0a4i-0020002090-1cf2e194037cb6fd901f
Source of Spectrum	SO-0-712-27
Synonyms	4-Phenylenebis[5-(4-bromophenyl)-2'-(2,5':2',5''-terpyrimidine)]
Wiley ID	874547