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3-(1,5-DIMETHYL-4-NITROSO-1H-3-PYRAZOLYL)-5-METHYL-ISOXAZOLE
SpectraBase Compound ID Cn8H0oi3UX5
InChI InChI=1S/C9H10N4O2/c1-5-4-7(12-15-5)9-8(11-14)6(2)13(3)10-9/h4H,1-3H3
InChIKey BBEZPFHKFNUTIP-UHFFFAOYSA-N
Mol Weight 206.2 g/mol
Molecular Formula C9H10N4O2
Exact Mass 206.080376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KchmSWA1AwX
Name 3-(1,5-DIMETHYL-4-NITROSO-1H-3-PYRAZOLYL)-5-METHYL-ISOXAZOLE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10N4O2
InChI InChI=1S/C9H10N4O2/c1-5-4-7(12-15-5)9-8(11-14)6(2)13(3)10-9/h4H,1-3H3
InChIKey BBEZPFHKFNUTIP-UHFFFAOYSA-N
Literature Reference Author E.AIELLO,S.AIELLO,F.MINGOIA,A.BACCHI,G.PELIZZI,C.MUSIU,M.G.S ETZU,A.PANI,P.L.COLL
Literature Reference Citation BIOORG.MED.CHEM.,8,2719(2000)
Literature Reference DOI 10.1016/S0968-0896(00)00211-X
Molecular Weight 206.204 g/mol
Solvent DMSO-D6
Source File Reference UWVN20508