For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-[(1E)-2-(5-Ethoxybenzothiazol-2-yl)diazenyl]-N-{(1E,2E)-2-{{4-(1(E)-2-(5-nitrobenzothiazol-2-yl)diazenyl]phenyl}imino}ethylidene}benzenamine
SpectraBase Compound ID 26zmdG4MQYA
InChI InChI=1S/C30H21N9O3S2/c1-2-42-24-12-14-28-26(18-24)34-30(44-28)38-36-22-9-5-20(6-10-22)32-16-15-31-19-3-7-21(8-4-19)35-37-29-33-25-17-23(39(40)41)11-13-27(25)43-29/h3-18H,2H2,1H3/b31-15+,32-16+,37-35+,38-36+
InChIKey VCFYKBKZQHYHRW-WIGRDJFWSA-N
Mol Weight 619.68 g/mol
Molecular Formula C30H21N9O3S2
Exact Mass 619.120878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9BtF4SIy82B
Name 4-[(1E)-2-(5-Ethoxybenzothiazol-2-yl)diazenyl]-N-{(1E,2E)-2-{{4-(1(E)-2-(5-nitrobenzothiazol-2-yl)diazenyl]phenyl}imino}ethylidene}benzenamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H21N9O3S2
InChI InChI=1S/C30H21N9O3S2/c1-2-42-24-12-14-28-26(18-24)34-30(44-28)38-36-22-9-5-20(6-10-22)32-16-15-31-19-3-7-21(8-4-19)35-37-29-33-25-17-23(39(40)41)11-13-27(25)43-29/h3-18H,2H2,1H3/b31-15+,32-16+,37-35+,38-36+
InChIKey VCFYKBKZQHYHRW-WIGRDJFWSA-N
Literature Reference DOI 10.1002/hlca.201200080
Molecular Weight 619.678 g/mol
SMILES c1(nc2cc([N+]([O-])=O)ccc2s1)\N=N\c1ccc(\N=C\C=N\c2ccc(\N=N\c3nc4cc(OCC)ccc4s3)cc2)cc1
SPLASH splash10-0006-5900000000-240c8ad200d06c812be3
Source of Spectrum H-95-1554-4b
Synonyms (1E,2E)-N1-(4-((E)-(5-ethoxybenzo[d]thiazol-2-yl)diazenyl)phenyl)-N2-(4-((E)-(5-nitrobenzo[d]thiazol-2-yl)diazenyl)phenyl)ethane-1,2-diimine
Wiley ID 1784483