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5,5-DIMETHYL-3-PHENYL-4,5-DIHYDRO-1,2,4-TRIAZINE-6(1H)-THIONE
SpectraBase Compound ID 1GoP9rPs6Ed
InChI InChI=1S/C11H13N3S/c1-11(2)10(15)14-13-9(12-11)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,12,13)(H,14,15)
InChIKey ZUVWZVFDIQTCHC-UHFFFAOYSA-N
Mol Weight 219.31 g/mol
Molecular Formula C11H13N3S
Exact Mass 219.083019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6BYg39h48Kb
Name 5,5-DIMETHYL-3-PHENYL-4,5-DIHYDRO-1,2,4-TRIAZINE-6(1H)-THIONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H13N3S
InChI InChI=1S/C11H13N3S/c1-11(2)10(15)14-13-9(12-11)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,12,13)(H,14,15)
InChIKey ZUVWZVFDIQTCHC-UHFFFAOYSA-N
Literature Reference Author D.J.COLLINS,T.C.HUGHES,W.M.JOHNSON
Literature Reference Citation AUSTR.J.CHEM.,53,137(2000)
Literature Reference DOI 10.1071/CH99156
Molecular Weight 219.304 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWSI2871