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3-METHYL-2,2,5-TRIPHENYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE

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3-METHYL-2,2,5-TRIPHENYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID rwg7aYaCeE
InChI InChI=1S/C21H18N2S/c1-23-21(18-13-7-3-8-14-18,19-15-9-4-10-16-19)24-20(22-23)17-11-5-2-6-12-17/h2-16H,1H3
InChIKey QKEYNGGGMUBLLT-UHFFFAOYSA-N
Mol Weight 330.45 g/mol
Molecular Formula C21H18N2S
Exact Mass 330.11907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8a4j7qMZpkW
Name 3-METHYL-2,2,5-TRIPHENYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
Compound Number 24A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18N2S
InChI InChI=1S/C21H18N2S/c1-23-21(18-13-7-3-8-14-18,19-15-9-4-10-16-19)24-20(22-23)17-11-5-2-6-12-17/h2-16H,1H3
InChIKey QKEYNGGGMUBLLT-UHFFFAOYSA-N
Literature Reference Author J.B.F.DUNSTAN,G.M.ELSEY,R.A.RUSSELL,G.P.SAVAGE,G.W.SIMPSON,E .R.T.TIEKINK
Literature Reference Citation AUSTR.J.CHEM.,51,499(1998)
Literature Reference DOI 10.1071/C97157
Molecular Weight 330.447 g/mol
Solvent CDCl3
Source File Reference WANG2423