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1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 6-(1,3-benzodioxol-5-yl)-3-cyclopropyl-4-(difluoromethyl)-, ethyl ester
SpectraBase Compound ID 4apHHpu86gI
InChI InChI=1S/C21H19F2N3O4/c1-2-28-17(27)9-26-21-18(19(25-26)11-3-4-11)13(20(22)23)8-14(24-21)12-5-6-15-16(7-12)30-10-29-15/h5-8,11,20H,2-4,9-10H2,1H3
InChIKey NOIUDHYNZPYBAZ-UHFFFAOYSA-N
Mol Weight 415.4 g/mol
Molecular Formula C21H19F2N3O4
Exact Mass 415.134362 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9JXOvB8cvIv
Name 1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 6-(1,3-benzodioxol-5-yl)-3-cyclopropyl-4-(difluoromethyl)-, 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/C21H19F2N3O4/c1-2-28-17(27)9-26-21-18(19(25-26)11-3-4-11)13(20(22)23)8-14(24-21)12-5-6-15-16(7-12)30-10-29-15/h5-8,11,20H,2-4,9-10H2,1H3
InChIKey NOIUDHYNZPYBAZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_22974
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: 2257425; UZI_ID: UZI-022982
Temperature 308 °C