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4,5-DIHYDRO-3-METHYL-1-PHENYL-1H-[1,2,4]-TRIAZOLINE-5-THIONE
SpectraBase Compound ID 7qXqg7ZWvw1
InChI InChI=1S/C9H9N3S/c1-7-10-9(13)12(11-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,10,11,13)
InChIKey XQWCFPGCYIZPGL-UHFFFAOYSA-N
Mol Weight 191.25 g/mol
Molecular Formula C9H9N3S
Exact Mass 191.051718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IK8y68zwDfo
Name 4,5-DIHYDRO-3-METHYL-1-PHENYL-1H-[1,2,4]-TRIAZOLINE-5-THIONE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N3S
InChI InChI=1S/C9H9N3S/c1-7-10-9(13)12(11-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,10,11,13)
InChIKey XQWCFPGCYIZPGL-UHFFFAOYSA-N
Literature Reference Author J.G.SCHANTL,S.LANG,K.WURST
Literature Reference Citation HETEROCYCLES,50,251(1999)
Literature Reference DOI 10.3987/COM-98-S(H)35
Molecular Weight 191.251 g/mol
Solvent DMSO-D6
Source File Reference UWGE6081