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4-piperidinol, 4-[3-(6-chloro-4,7-dimethoxy-1,3-benzodioxol-5-yl)-5-isoxazolyl]-1-methyl-
SpectraBase Compound ID 2C9ZVr1dquS
InChI InChI=1S/C18H21ClN2O6/c1-21-6-4-18(22,5-7-21)11-8-10(20-27-11)12-13(19)15(24-3)17-16(14(12)23-2)25-9-26-17/h8,22H,4-7,9H2,1-3H3
InChIKey KZZUQFOKFFMYSF-UHFFFAOYSA-N
Mol Weight 396.83 g/mol
Molecular Formula C18H21ClN2O6
Exact Mass 396.108814 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B3AFjjNPuhB
Name 4-piperidinol, 4-[3-(6-chloro-4,7-dimethoxy-1,3-benzodioxol-5-yl)-5-isoxazolyl]-1-methyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H21ClN2O6/c1-21-6-4-18(22,5-7-21)11-8-10(20-27-11)12-13(19)15(24-3)17-16(14(12)23-2)25-9-26-17/h8,22H,4-7,9H2,1-3H3
InChIKey KZZUQFOKFFMYSF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5156
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/17311358; Labnumber: 203