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3-(2-Phenylquinolin-4-yl)-6-(p-bromophenyl)-7H-1,2,4-triazolo-[3,4-b]-1,3,4-thiadiazine

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3-(2-Phenylquinolin-4-yl)-6-(p-bromophenyl)-7H-1,2,4-triazolo-[3,4-b]-1,3,4-thiadiazine
SpectraBase Compound ID 55J4gaGaF9a
InChI InChI=1S/C25H16BrN5S/c26-18-12-10-17(11-13-18)23-15-32-25-29-28-24(31(25)30-23)20-14-22(16-6-2-1-3-7-16)27-21-9-5-4-8-19(20)21/h1-14H,15H2
InChIKey FQBCMUQQCWNEJN-UHFFFAOYSA-N
Mol Weight 498.4 g/mol
Molecular Formula C25H16BrN5S
Exact Mass 497.03098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wzADgdQBc
Name 3-(2-Phenylquinolin-4-yl)-6-(p-bromophenyl)-7H-1,2,4-triazolo-[3,4-b]-1,3,4-thiadiazine
Alternate Name(s) 6-(4-bromophenyl)-3-(2-phenylquinolin-4-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H16BrN5S
InChI InChI=1S/C25H16BrN5S/c26-18-12-10-17(11-13-18)23-15-32-25-29-28-24(31(25)30-23)20-14-22(16-6-2-1-3-7-16)27-21-9-5-4-8-19(20)21/h1-14H,15H2
InChIKey FQBCMUQQCWNEJN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200000149
Molecular Weight 498.402 g/mol
SMILES c12SCC(=N[n]2c(nn1)-c1cc(nc2ccccc12)-c1ccccc1)c1ccc(cc1)Br
SPLASH splash10-0fbc-1695400000-18848cffbf26e8603a5e
Source of Spectrum QA-47-1118-6a
Wiley ID 1795135