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Tetrabenzo[b,d,h,j][1,6]diazacyclododecine
SpectraBase Compound ID 5sZA3bwShLa
InChI InChI=1S/C26H18N2/c1-3-11-21-19(9-1)17-27-25-15-7-5-13-23(25)24-14-6-8-16-26(24)28-18-20-10-2-4-12-22(20)21/h1-18H/b19-17-,20-18-,22-21-,24-23-,27-17-,27-25-,28-18-,28-26-
InChIKey IJXNIPITMSENPV-UIUHIEDHSA-N
Mol Weight 358.44 g/mol
Molecular Formula C26H18N2
Exact Mass 358.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GURADyvOV3f
Name Tetrabenzo[b,d,h,j][1,6]diazacyclododecine
CAS Registry Number 7428-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H18N2
InChI InChI=1S/C26H18N2/c1-3-11-21-19(9-1)17-27-25-15-7-5-13-23(25)24-14-6-8-16-26(24)28-18-20-10-2-4-12-22(20)21/h1-18H/b19-17-,20-18-,22-21-,24-23-,27-17-,27-25-,28-18-,28-26-
InChIKey IJXNIPITMSENPV-UIUHIEDHSA-N
Molecular Weight 358.444 g/mol
SMILES c12\C=N/c3c(-c4c(\N=C/c5c(-c2cccc1)cccc5)cccc4)cccc3
SPLASH splash10-0a4i-1906000000-bf52c73b28579faa18bc
Source of Spectrum 0-16-123-1
Wiley ID 53052