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1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-7-(4-methoxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 7vn8an81SYO
InChI InChI=1S/C22H17F3N2O4/c1-31-15-7-5-12(6-8-15)16-10-18(28)26-19-17(21(29)30)11-27(20(16)19)14-4-2-3-13(9-14)22(23,24)25/h2-9,11,16H,10H2,1H3,(H,26,28)(H,29,30)
InChIKey OCOUMWAPOFIDBD-UHFFFAOYSA-N
Mol Weight 430.38 g/mol
Molecular Formula C22H17F3N2O4
Exact Mass 430.114042 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I3K3XYGs7g4
Name 1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-7-(4-methoxyphenyl)-5-oxo-1-[3-(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/C22H17F3N2O4/c1-31-15-7-5-12(6-8-15)16-10-18(28)26-19-17(21(29)30)11-27(20(16)19)14-4-2-3-13(9-14)22(23,24)25/h2-9,11,16H,10H2,1H3,(H,26,28)(H,29,30)
InChIKey OCOUMWAPOFIDBD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6357
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/18211579; Labnumber: 2870