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6,6'-Bis[3-(4-pyrimidinyl)phenyl]-4,4'-bipyrimidine
SpectraBase Compound ID JKZqnK9qitf
InChI InChI=1S/C28H18N8/c1-3-19(23-7-9-29-15-31-23)11-21(5-1)25-13-27(35-17-33-25)28-14-26(34-18-36-28)22-6-2-4-20(12-22)24-8-10-30-16-32-24/h1-18H
InChIKey HXIXKMCYBZVYOM-UHFFFAOYSA-N
Mol Weight 466.51 g/mol
Molecular Formula C28H18N8
Exact Mass 466.165443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID goO21hdhUF
Name 6,6'-Bis[3-(4-pyrimidinyl)phenyl]-4,4'-bipyrimidine
Alternate Name(s) 6,6'-bis(3-(pyrimidin-4-yl)phenyl)-4,4'-bipyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H18N8
InChI InChI=1S/C28H18N8/c1-3-19(23-7-9-29-15-31-23)11-21(5-1)25-13-27(35-17-33-25)28-14-26(34-18-36-28)22-6-2-4-20(12-22)24-8-10-30-16-32-24/h1-18H
InChIKey HXIXKMCYBZVYOM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19801130817
Molecular Weight 466.508 g/mol
SMILES c1ccc(cc1-c1ccncn1)-c1ncnc(c1)-c1ncnc(c1)-c1cc(-c2ccncn2)ccc1
SPLASH splash10-014i-0000900000-95e1f9b2a5a24992ed4f
Source of Spectrum K-113-2747-10
Wiley ID 1794400