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isoxazole, 5-[[4-[(E)-[(aminocarbonyl)hydrazono]methyl]-6,7-dimethoxy-1,3-benzodioxol-5-yl]methyl]-3-(4-fluorophenyl)-4,5-dihydro-

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isoxazole, 5-[[4-[(E)-[(aminocarbonyl)hydrazono]methyl]-6,7-dimethoxy-1,3-benzodioxol-5-yl]methyl]-3-(4-fluorophenyl)-4,5-dihydro-
SpectraBase Compound ID 5oiwV4Or40X
InChI InChI=1S/C21H21FN4O6/c1-28-17-14(7-13-8-16(26-32-13)11-3-5-12(22)6-4-11)15(9-24-25-21(23)27)18-20(19(17)29-2)31-10-30-18/h3-6,9,13H,7-8,10H2,1-2H3,(H3,23,25,27)/b24-9+
InChIKey ACIOOMFYBIUQLJ-PGGKNCGUSA-N
Mol Weight 444.42 g/mol
Molecular Formula C21H21FN4O6
Exact Mass 444.144513 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 35f3F9jtShD
Name isoxazole, 5-[[4-[(E)-[(aminocarbonyl)hydrazono]methyl]-6,7-dimethoxy-1,3-benzodioxol-5-yl]methyl]-3-(4-fluorophenyl)-4,5-dihydro-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H21FN4O6/c1-28-17-14(7-13-8-16(26-32-13)11-3-5-12(22)6-4-11)15(9-24-25-21(23)27)18-20(19(17)29-2)31-10-30-18/h3-6,9,13H,7-8,10H2,1-2H3,(H3,23,25,27)/b24-9+
InChIKey ACIOOMFYBIUQLJ-PGGKNCGUSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5060
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/17311210; Labnumber: 55