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

*Links on SpectraBase are not permalinks.
3-(4-Chlorophenyl)-6-oxo-8,10-diphenyl-2H,6H-pyrido[2,1-f][1,3,4]thiadiazino[2,3-c][1,2,4]triazin-11-ium bromide
SpectraBase Compound ID AUuPFhLiift
InChI InChI=1S/C27H18ClN4OS.BrH/c28-22-13-11-19(12-14-22)23-17-34-27-30-31-24(20-9-5-2-6-10-20)15-21(18-7-3-1-4-8-18)16-25(31)26(33)32(27)29-23;/h1-16H,17H2;1H/q+1;/p-1
InChIKey ZLXUUHMLPJBSON-UHFFFAOYSA-M
Mol Weight 561.89 g/mol
Molecular Formula C27H18BrClN4OS
Exact Mass 560.007323 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 GHr5uqv9frg
Name 3-(4-Chlorophenyl)-6-oxo-8,10-diphenyl-2H,6H-pyrido[2,1-f][1,3,4]thiadiazino[2,3-c][1,2,4]triazin-11-ium bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H18BrClN4OS
InChI InChI=1S/C27H18ClN4OS.BrH/c28-22-13-11-19(12-14-22)23-17-34-27-30-31-24(20-9-5-2-6-10-20)15-21(18-7-3-1-4-8-18)16-25(31)26(33)32(27)29-23;/h1-16H,17H2;1H/q+1;/p-1
InChIKey ZLXUUHMLPJBSON-UHFFFAOYSA-M
Molecular Weight 561.885 g/mol
SMILES [Br-].c12[n+](N=C3N(C2=O)N=C(CS3)c2ccc(Cl)cc2)c(cc(c1)-c1ccccc1)-c1ccccc1
SPLASH splash10-001i-9460000000-1429dc6a06fc93274d90
Source of Spectrum SO-0-698-4
Synonyms 2-(4-Chlorophenyl)-11-oxo-7,9-diphenyl-3H,11H-pyrido[2',1':6,1][1,2,4]triazino[3,4-b][1,3,4]thiadiazin-6-ium bromide
Wiley ID 1538300