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4H-1-benzopyran-3-carbonitrile, 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-7-(dimethylamino)-
SpectraBase Compound ID K3BWvO1jL3H
InChI InChI=1S/C21H21N3O5/c1-24(2)11-5-6-12-15(7-11)29-21(23)14(9-22)17(12)13-8-16-19(28-10-27-16)20(26-4)18(13)25-3/h5-8,17H,10,23H2,1-4H3
InChIKey JHAPKZPCYGOREM-UHFFFAOYSA-N
Mol Weight 395.42 g/mol
Molecular Formula C21H21N3O5
Exact Mass 395.148121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G4ruU7Hsigt
Name 4H-1-benzopyran-3-carbonitrile, 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-7-(dimethylamino)-
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/C21H21N3O5/c1-24(2)11-5-6-12-15(7-11)29-21(23)14(9-22)17(12)13-8-16-19(28-10-27-16)20(26-4)18(13)25-3/h5-8,17H,10,23H2,1-4H3
InChIKey JHAPKZPCYGOREM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6509
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/18211748; Labnumber: TSH-804/2200