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2-Phenyl-5-methoxy-1,2,4-triazolin-3-one
SpectraBase Compound ID K0DGW4KzXcE
InChI InChI=1S/C9H9N3O2/c1-14-8-10-9(13)12(11-8)7-5-3-2-4-6-7/h2-6H,1H3,(H,10,11,13)
InChIKey AQSDHRKBJCVZKW-UHFFFAOYSA-N
Mol Weight 191.19 g/mol
Molecular Formula C9H9N3O2
Exact Mass 191.069477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L3T2Qq43Dqa
Name 2-PHENYL-5-METHOXY-1,2,4-TRIAZOLIN-3-ONE
CAS Registry Number 14500-22-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N3O2
InChI InChI=1S/C9H9N3O2/c1-14-8-10-9(13)12(11-8)7-5-3-2-4-6-7/h2-6H,1H3,(H,10,11,13)
InChIKey AQSDHRKBJCVZKW-UHFFFAOYSA-N
Literature Reference Author S.S.JONES,D.B.STAIGER,D.F.CHODOSH
Literature Reference Citation J.ORG.CHEM.,47,1969(1982)
Literature Reference DOI 10.1021/jo00349a031
Molecular Weight 191.189 g/mol
Solvent DMSO-D6
Source File Reference UNIW18668