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Tribenzo[c,g,k][1,2,5,6,9,10]hexaazacyclododecine, (E,E,E)-
SpectraBase Compound ID KPfF5guHTxw
InChI InChI=1S/C18H12N6/c1-2-8-14-13(7-1)19-21-15-9-3-4-10-16(15)23-24-18-12-6-5-11-17(18)22-20-14/h1-12H/b19-13-,20-14-,21-15+,21-19+,22-17+,22-20+,23-16-,24-18+,24-23+
InChIKey AZBJGKBLGLXZGU-ZALAUOSRSA-N
Mol Weight 312.34 g/mol
Molecular Formula C18H12N6
Exact Mass 312.112344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6kvYOKd4ye
Name Tribenzo[c,g,k][1,2,5,6,9,10]hexaazacyclododecine, (E,E,E)-
CAS Registry Number 98081-63-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N6
InChI InChI=1S/C18H12N6/c1-2-8-14-13(7-1)19-21-15-9-3-4-10-16(15)23-24-18-12-6-5-11-17(18)22-20-14/h1-12H/b19-13-,20-14-,21-15+,21-19+,22-17+,22-20+,23-16-,24-18+,24-23+
InChIKey AZBJGKBLGLXZGU-ZALAUOSRSA-N
Molecular Weight 312.336 g/mol
SMILES c12\N=N\c3c(\N=N\c4c(\N=N\c2cccc1)cccc4)cccc3
SPLASH splash10-03fr-9424000000-a82d03b83ed6503a36de
Source of Spectrum H-68-333-7
Synonyms (5E,6aZ,11E,12aZ,17E,18aZ)-5,6,11,12,17,18-hexaazatribenzo[aei][1,3,5,7,9,11]cyclododecahexaene Cyclotrisazobenzene Tribenzo[c,g,k][1,2,5,6,9,10]hexaazacyclododecine
Wiley ID 1313295