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[(1,3-Diphenyl-1H-1,2,4-triazol-5-yl)imino](ethyl)(phenyl)-.lambda.6-sulfanone
SpectraBase Compound ID BB2HAGKoGPw
InChI InChI=1S/C22H20N4OS/c1-2-28(27,20-16-10-5-11-17-20)25-22-23-21(18-12-6-3-7-13-18)24-26(22)19-14-8-4-9-15-19/h3-17H,2H2,1H3
InChIKey DKEJVLCLHUUCOZ-UHFFFAOYSA-N
Mol Weight 388.49 g/mol
Molecular Formula C22H20N4OS
Exact Mass 388.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FB1apPZYu5k
Name [(1,3-Diphenyl-1H-1,2,4-triazol-5-yl)imino](ethyl)(phenyl)-.lambda.6-sulfanone
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N4OS
InChI InChI=1S/C22H20N4OS/c1-2-28(27,20-16-10-5-11-17-20)25-22-23-21(18-12-6-3-7-13-18)24-26(22)19-14-8-4-9-15-19/h3-17H,2H2,1H3
InChIKey DKEJVLCLHUUCOZ-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000335
Molecular Weight 388.489 g/mol
Reported Formula C22H20ON4S
SMILES C(S(c1ccccc1)(=Nc1[n](-c2ccccc2)nc(-c2ccccc2)n1)=O)C
SPLASH splash10-002r-5429000000-1dfc39e8044b956abcbe
Source of Spectrum U1-2020-SM4-7i
Wiley ID 1860526