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pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-(1,3-benzodioxol-5-yl)-1,4-dihydro-4-[2-(trifluoromethyl)phenyl]-
SpectraBase Compound ID HVl64CqCAjg
InChI InChI=1S/C21H13F3N4O3/c22-21(23,24)13-4-2-1-3-11(13)16-12(8-25)19(26)31-20-17(16)18(27-28-20)10-5-6-14-15(7-10)30-9-29-14/h1-7,16H,9,26H2,(H,27,28)
InChIKey YNVVZHORSRVROB-UHFFFAOYSA-N
Mol Weight 426.36 g/mol
Molecular Formula C21H13F3N4O3
Exact Mass 426.093975 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4AOMIesRaad
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-(1,3-benzodioxol-5-yl)-1,4-dihydro-4-[2-(trifluoromethyl)phenyl]-
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/C21H13F3N4O3/c22-21(23,24)13-4-2-1-3-11(13)16-12(8-25)19(26)31-20-17(16)18(27-28-20)10-5-6-14-15(7-10)30-9-29-14/h1-7,16H,9,26H2,(H,27,28)
InChIKey YNVVZHORSRVROB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_3160
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/11248769