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1-(3-Methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-6,7-dicarbonitrile
SpectraBase Compound ID 6DSJZFILVTU
InChI InChI=1S/C17H9N5OS/c1-23-13-4-2-3-10(5-13)16-20-21-17-22(16)14-6-11(8-18)12(9-19)7-15(14)24-17/h2-7H,1H3
InChIKey NORGXKISAHUDRG-UHFFFAOYSA-N
Mol Weight 331.35 g/mol
Molecular Formula C17H9N5OS
Exact Mass 331.052781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DUWvJM0emc
Name 1-(3-Methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-6,7-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H9N5OS
InChI InChI=1S/C17H9N5OS/c1-23-13-4-2-3-10(5-13)16-20-21-17-22(16)14-6-11(8-18)12(9-19)7-15(14)24-17/h2-7H,1H3
InChIKey NORGXKISAHUDRG-UHFFFAOYSA-N
Molecular Weight 331.353 g/mol
SMILES COc1cc(-c2[n]-3c(nn2)Sc2c3cc(c(C#N)c2)C#N)ccc1
SPLASH splash10-001i-2219000000-b3893e7ced279c5d3574
Wiley ID 1511908