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2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile

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2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SpectraBase Compound ID 3TACMjLxOgi
InChI InChI=1S/C26H25N3O3/c1-15-5-4-6-17(9-15)29-19-11-26(2,3)12-20(30)24(19)23(18(13-27)25(29)28)16-7-8-21-22(10-16)32-14-31-21/h4-10,23H,11-12,14,28H2,1-3H3
InChIKey WONURQCEGOKZQV-UHFFFAOYSA-N
Mol Weight 427.5 g/mol
Molecular Formula C26H25N3O3
Exact Mass 427.189592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IPD0GIez7aw
Name 2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
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/C26H25N3O3/c1-15-5-4-6-17(9-15)29-19-11-26(2,3)12-20(30)24(19)23(18(13-27)25(29)28)16-7-8-21-22(10-16)32-14-31-21/h4-10,23H,11-12,14,28H2,1-3H3
InChIKey WONURQCEGOKZQV-UHFFFAOYSA-N
NMR Offset 16.9826
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_143
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: ZI/7016297; Labnumber: DUD-4200020
Temperature 297 °C