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2-Butanoyl-3-hydroxy-5-(3-isopropyl-5-isoxazolyl)-2-cyclohexenone

View entire compound with spectra: 1 NMR, and 1 FTIR

2-Butanoyl-3-hydroxy-5-(3-isopropyl-5-isoxazolyl)-2-cyclohexenone
SpectraBase Compound ID FV9FEBxCZ8d
InChI InChI=1S/C16H21NO4/c1-4-5-12(18)16-13(19)6-10(7-14(16)20)15-8-11(9(2)3)17-21-15/h8-10,19H,4-7H2,1-3H3
InChIKey UJTHVTOLAWRMAE-UHFFFAOYSA-N
Mol Weight 291.35 g/mol
Molecular Formula C16H21NO4
Exact Mass 291.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8xFZPkSZbOD
Name 2-Butanoyl-3-hydroxy-5-(3-isopropyl-5-isoxazolyl)-2-cyclohexenone
CAS Registry Number 107005-95-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H21NO4
InChI InChI=1S/C16H21NO4/c1-4-5-12(18)16-13(19)6-10(7-14(16)20)15-8-11(9(2)3)17-21-15/h8-10,19H,4-7H2,1-3H3
InChIKey UJTHVTOLAWRMAE-UHFFFAOYSA-N
Instrument Name Bruker AC-250
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6