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2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]propyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-4-yl)-5-isoxazolyl]-
SpectraBase Compound ID LYzq9yZ4BZy
InChI InChI=1S/C21H28N2O5/c1-3-5-8-27-22-16(4-2)21-18(24)11-15(12-19(21)25)20-13-17(23-28-20)14-6-9-26-10-7-14/h3,5,13-15,24H,4,6-12H2,1-2H3/b5-3+,22-16+
InChIKey WPLMWRPHKDKVCU-BCRXBJKHSA-N
Mol Weight 388.46 g/mol
Molecular Formula C21H28N2O5
Exact Mass 388.199822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KERXUmfrstZ
Name 2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]propyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-4-yl)-5-isoxazolyl]-
CAS Registry Number 130113-46-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H28N2O5
InChI InChI=1S/C21H28N2O5/c1-3-5-8-27-22-16(4-2)21-18(24)11-15(12-19(21)25)20-13-17(23-28-20)14-6-9-26-10-7-14/h3,5,13-15,24H,4,6-12H2,1-2H3/b5-3+,22-16+
InChIKey WPLMWRPHKDKVCU-BCRXBJKHSA-N
Instrument Name Nicolet QE-300
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3