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2-(benzyl)-5-methyl-3H-triazol-4-one

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2-(benzyl)-5-methyl-3H-triazol-4-one
SpectraBase Compound ID AuJbS9re652
InChI InChI=1S/C10H11N3O/c1-8-10(14)12-13(11-8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,14)
InChIKey ZSCCLAZGYCOUBF-UHFFFAOYSA-N
Mol Weight 189.22 g/mol
Molecular Formula C10H11N3O
Exact Mass 189.090212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4sNqLAxWpuC
Name 2-(benzyl)-5-methyl-3H-triazol-4-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H11N3O
InChI InChI=1S/C10H11N3O/c1-8-10(14)12-13(11-8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,14)
InChIKey ZSCCLAZGYCOUBF-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 189.217 g/mol
Source File Reference MHKO169