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4-acetyl-5-methyl-3-(p-nitrophenyl)isoxazole

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4-acetyl-5-methyl-3-(p-nitrophenyl)isoxazole
SpectraBase Compound ID 1Q5YLLc7Smd
InChI InChI=1S/C12H10N2O4/c1-7(15)11-8(2)18-13-12(11)9-3-5-10(6-4-9)14(16)17/h3-6H,1-2H3
InChIKey PCOCNIXRHQMPRP-UHFFFAOYSA-N
Mol Weight 246.22 g/mol
Molecular Formula C12H10N2O4
Exact Mass 246.064057 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CsrxWhS31TX
Name 4-acetyl-5-methyl-3-(p-nitrophenyl)isoxazole
Source of Sample M. Giannella, University of Camerino, Camerino, Italy
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O4
InChI InChI=1S/C12H10N2O4/c1-7(15)11-8(2)18-13-12(11)9-3-5-10(6-4-9)14(16)17/h3-6H,1-2H3
InChIKey PCOCNIXRHQMPRP-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference Abstract-Chemical Abstracts= 66, 104945(1967)
Sadtler NMR Number 5947M
Solvent CDCl3
Synonyms KETONE, METHYL 5-METHYL-3-/P-NITRO- PHENYL/-4-ISOXAZOLYL, ISOXAZOLE, 4-ACETYL-5-METHYL-3- /P-NITROPHENYL/-,