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4,4''',6,6'''-Tetraaza-m-hexaphenylene
SpectraBase Compound ID ILXZxTpFbDB
InChI InChI=1S/C32H20N4/c1-5-21-13-25(9-1)29-17-30(34-19-33-29)27-11-3-7-23(15-27)24-8-4-12-28(16-24)32-18-31(35-20-36-32)26-10-2-6-22(21)14-26/h1-20H
InChIKey JHXSKYTVQOWUHP-UHFFFAOYSA-N
Mol Weight 460.5 g/mol
Molecular Formula C32H20N4
Exact Mass 460.168797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jiARO3s8GE
Name 4,4''',6,6'''-Tetraaza-m-hexaphenylene
Alternate Name(s) 1,4(4,6)-dipyrimidina-2,3,5,6(1,3)-tetrabenzenacyclohexaphane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H20N4
InChI InChI=1S/C32H20N4/c1-5-21-13-25(9-1)29-17-30(34-19-33-29)27-11-3-7-23(15-27)24-8-4-12-28(16-24)32-18-31(35-20-36-32)26-10-2-6-22(21)14-26/h1-20H
InChIKey JHXSKYTVQOWUHP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19801130817
Molecular Weight 460.540 g/mol
SMILES c1nc-2cc(n1)-c1cccc(-c3cccc(-c4cc(-c5cc(-c6cc2ccc6)ccc5)ncn4)c3)c1
SPLASH splash10-03di-1000900000-c2407935a4d0bd670174
Source of Spectrum K-113-2745-4
Wiley ID 1794404