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1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(trifluoromethyl)-, ethyl ester

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1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(trifluoromethyl)-, ethyl ester
SpectraBase Compound ID 6g4WTOGDrWw
InChI InChI=1S/C22H20F3N3O4/c1-2-30-18(29)11-28-21-19(20(27-28)12-3-4-12)14(22(23,24)25)10-15(26-21)13-5-6-16-17(9-13)32-8-7-31-16/h5-6,9-10,12H,2-4,7-8,11H2,1H3
InChIKey VXDOCZOUKYYOGN-UHFFFAOYSA-N
Mol Weight 447.41 g/mol
Molecular Formula C22H20F3N3O4
Exact Mass 447.140591 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GTKhkng9t6p
Name 1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(trifluoromethyl)-, ethyl ester
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/C22H20F3N3O4/c1-2-30-18(29)11-28-21-19(20(27-28)12-3-4-12)14(22(23,24)25)10-15(26-21)13-5-6-16-17(9-13)32-8-7-31-16/h5-6,9-10,12H,2-4,7-8,11H2,1H3
InChIKey VXDOCZOUKYYOGN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_22589
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: 2226905; UZI_ID: UZI-022597
Temperature 308 °C