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Dibenzo[b,h][1,4,7,10]tetraazacyclododecine

View entire compound with spectra: 1 MS (GC)

Dibenzo[b,h][1,4,7,10]tetraazacyclododecine
SpectraBase Compound ID DnS35yiCWVA
InChI InChI=1S/C16H12N4/c1-2-6-14-13(5-1)17-9-10-19-15-7-3-4-8-16(15)20-12-11-18-14/h1-12H/b10-9-,12-11+,17-9+,17-13+,18-11+,18-14-,19-10+,19-15+,20-12?,20-16?
InChIKey ACRVZUOZTCXDOP-RITUVBBGSA-N
Mol Weight 260.3 g/mol
Molecular Formula C16H12N4
Exact Mass 260.106196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OpcbYV3WFw
Name Dibenzo[b,h][1,4,7,10]tetraazacyclododecine
CAS Registry Number 38063-20-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4
InChI InChI=1S/C16H12N4/c1-2-6-14-13(5-1)17-9-10-19-15-7-3-4-8-16(15)20-12-11-18-14/h1-12H/b10-9-,12-11+,17-9+,17-13+,18-11+,18-14-,19-10+,19-15+,20-12?,20-16?
InChIKey ACRVZUOZTCXDOP-RITUVBBGSA-N
Molecular Weight 260.300 g/mol
SMILES C1=C\C2=N/C=C\N=C/3C=CC=C\C3=N/C=C/N=C2C=C1
SPLASH splash10-03di-5390000000-b29a295e066fe2caf1d3
Source of Spectrum W5-1989-33253-32283
Wiley ID 1263940