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2-amino-1-(3-bromophenyl)-4-{3-[(4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SpectraBase Compound ID G5BdPicaArj
InChI InChI=1S/C30H25BrFN3O3/c1-37-27-13-8-18(14-19(27)17-38-23-11-9-21(32)10-12-23)28-24(16-33)30(34)35(22-5-2-4-20(31)15-22)25-6-3-7-26(36)29(25)28/h2,4-5,8-15,28H,3,6-7,17,34H2,1H3
InChIKey IJGAMFYSILRTOO-UHFFFAOYSA-N
Mol Weight 574.45 g/mol
Molecular Formula C30H25BrFN3O3
Exact Mass 573.106333 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 35GLM3JvzuQ
Name 2-amino-1-(3-bromophenyl)-4-{3-[(4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
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/C30H25BrFN3O3/c1-37-27-13-8-18(14-19(27)17-38-23-11-9-21(32)10-12-23)28-24(16-33)30(34)35(22-5-2-4-20(31)15-22)25-6-3-7-26(36)29(25)28/h2,4-5,8-15,28H,3,6-7,17,34H2,1H3
InChIKey IJGAMFYSILRTOO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13437
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: UZI/9131611; UBI_ID: UBI-013440
Temperature 318 °C