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3-METHYL-1,2,4-OXADIAZIN-6(5H)-ONE
SpectraBase Compound ID BVTiK0j442P
InChI InChI=1S/C4H6N2O2/c1-3-5-4(7)2-8-6-3/h2H2,1H3,(H,5,6,7)
InChIKey OTLKSNMRMQFDQI-UHFFFAOYSA-N
Mol Weight 114.1 g/mol
Molecular Formula C4H6N2O2
Exact Mass 114.042927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cq2kA5sPAuI
Name 3-METHYL-1,2,4-OXADIAZIN-6(5H)-ONE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H6N2O2
InChI InChI=1S/C4H6N2O2/c1-3-5-4(7)2-8-6-3/h2H2,1H3,(H,5,6,7)
InChIKey OTLKSNMRMQFDQI-UHFFFAOYSA-N
Literature Reference Author Y.DUERUEST
Literature Reference Citation MAGN.RES.CHEM.,36,878(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(1998110)36:11<878::aid-omr373>3.3.co;2-u
Molecular Weight 114.104 g/mol
Solvent CDCl3
Source File Reference UWCS24745