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3,5,5-TRIMETHYL-4(5H)-ISOXAZOLONE
SpectraBase Compound ID FlUDfXdm1To
InChI InChI=1S/C6H9NO2/c1-4-5(8)6(2,3)9-7-4/h1-3H3
InChIKey JQNVYESVCIEBIO-UHFFFAOYSA-N
Mol Weight 127.14 g/mol
Molecular Formula C6H9NO2
Exact Mass 127.063329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ElSIJyrROz9
Name 3,5,5-TRIMETHYL-4(5H)-ISOXAZOLONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H9NO2
InChI InChI=1S/C6H9NO2/c1-4-5(8)6(2,3)9-7-4/h1-3H3
InChIKey JQNVYESVCIEBIO-UHFFFAOYSA-N
Literature Reference Author F.STUNNENBERG,H.CERFONTAIN,J.A.J.GEENEVASEN,W.HIELKEMA
Literature Reference Citation REC.TR.CH.P.-B.,110,31(1991)
Literature Reference DOI 10.1002/recl.19911100202
Molecular Weight 127.143 g/mol
Solvent CDCl3
Source File Reference UWTS1693