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3-(3-bromo-4-hydroxy-5-methoxyphenyl)-5-(4-fluorophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione
SpectraBase Compound ID 1tNG6r342Eg
InChI InChI=1S/C24H18BrFN2O5/c1-32-18-12-13(11-17(25)21(18)29)20-19-22(33-28(20)16-5-3-2-4-6-16)24(31)27(23(19)30)15-9-7-14(26)8-10-15/h2-12,19-20,22,29H,1H3
InChIKey GDEBMACEGIKBHB-UHFFFAOYSA-N
Mol Weight 513.32 g/mol
Molecular Formula C24H18BrFN2O5
Exact Mass 512.038313 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2AseXPIQ8qO
Name 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-5-(4-fluorophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione
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/C24H18BrFN2O5/c1-32-18-12-13(11-17(25)21(18)29)20-19-22(33-28(20)16-5-3-2-4-6-16)24(31)27(23(19)30)15-9-7-14(26)8-10-15/h2-12,19-20,22,29H,1H3
InChIKey GDEBMACEGIKBHB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26706
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: D66417; Labnumber: VLM_NM-0735; SBI_ID: SBI-026710
Temperature 318 °C