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9H-[1,2,4]Triazolo[4,3-a][1,3]benzimidazole, 3-[[2-(4-methylphenoxy)ethyl]thio]-
SpectraBase Compound ID Ax94LqF9WV5
InChI InChI=1S/C17H16N4OS/c1-12-6-8-13(9-7-12)22-10-11-23-17-20-19-16-18-14-4-2-3-5-15(14)21(16)17/h2-9H,10-11H2,1H3,(H,18,19)
InChIKey SYXQVUSWEMSKQZ-UHFFFAOYSA-N
Mol Weight 324.4 g/mol
Molecular Formula C17H16N4OS
Exact Mass 324.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12J6SKmA7Sl
Name 9H-[1,2,4]Triazolo[4,3-a][1,3]benzimidazole, 3-[[2-(4-methylphenoxy)ethyl]thio]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4OS
InChI InChI=1S/C17H16N4OS/c1-12-6-8-13(9-7-12)22-10-11-23-17-20-19-16-18-14-4-2-3-5-15(14)21(16)17/h2-9H,10-11H2,1H3,(H,18,19)
InChIKey SYXQVUSWEMSKQZ-UHFFFAOYSA-N
Molecular Weight 324.402 g/mol
SMILES N1c2c(-[n]3c1nnc3SCCOc1ccc(cc1)C)cccc2
SPLASH splash10-0006-5900000000-a02b58136ebd8a72d93e
Source of Spectrum IY-2-4719-8
Synonyms 1-[2-(4-methylphenoxy)ethylsulfanyl]-3H-[1,2,4]triazolo[4,3-a]benzimidazole
Wiley ID 1655181