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Cyclopropyl[(1,3-diphenyl-1H-1,2,4-triazol-5-yl)imino](phenyl)-.lambda.6-sulfanone
SpectraBase Compound ID DmBgDFUYU3L
InChI InChI=1S/C23H20N4OS/c28-29(21-16-17-21,20-14-8-3-9-15-20)26-23-24-22(18-10-4-1-5-11-18)25-27(23)19-12-6-2-7-13-19/h1-15,21H,16-17H2
InChIKey UMMVTGBFZLZBCD-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C23H20N4OS
Exact Mass 400.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CzTAh33qiGo
Name Cyclopropyl[(1,3-diphenyl-1H-1,2,4-triazol-5-yl)imino](phenyl)-.lambda.6-sulfanone
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20N4OS
InChI InChI=1S/C23H20N4OS/c28-29(21-16-17-21,20-14-8-3-9-15-20)26-23-24-22(18-10-4-1-5-11-18)25-27(23)19-12-6-2-7-13-19/h1-15,21H,16-17H2
InChIKey UMMVTGBFZLZBCD-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000335
Molecular Weight 400.500 g/mol
Reported Formula C23H20ON4S
SMILES C1(S(c2ccccc2)(=Nc2[n](-c3ccccc3)nc(-c3ccccc3)n2)=O)CC1
SPLASH splash10-0ufu-7523900000-d315832758dca4d8db6b
Source of Spectrum U1-2020-SM5-7k
Wiley ID 1860528