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1,3-benzodioxole-4-carboxaldehyde, 5-[[3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolyl]methyl]-6,7-dimethoxy-

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1,3-benzodioxole-4-carboxaldehyde, 5-[[3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolyl]methyl]-6,7-dimethoxy-
SpectraBase Compound ID LUaTqUDl6K7
InChI InChI=1S/C20H18ClNO6/c1-24-17-14(15(9-23)18-20(19(17)25-2)27-10-26-18)7-13-8-16(22-28-13)11-3-5-12(21)6-4-11/h3-6,9,13H,7-8,10H2,1-2H3
InChIKey MXKWOGVKRULVHK-UHFFFAOYSA-N
Mol Weight 403.82 g/mol
Molecular Formula C20H18ClNO6
Exact Mass 403.082265 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JSsmKNlAY4N
Name 1,3-benzodioxole-4-carboxaldehyde, 5-[[3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolyl]methyl]-6,7-dimethoxy-
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/C20H18ClNO6/c1-24-17-14(15(9-23)18-20(19(17)25-2)27-10-26-18)7-13-8-16(22-28-13)11-3-5-12(21)6-4-11/h3-6,9,13H,7-8,10H2,1-2H3
InChIKey MXKWOGVKRULVHK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4974
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/17311122; Labnumber: 1