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4-[5-(4-ethoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl]benzonitrile
SpectraBase Compound ID 8nKXuP04ljk
InChI InChI=1S/C26H21N3O4/c1-2-32-21-14-12-19(13-15-21)28-25(30)22-23(18-10-8-17(16-27)9-11-18)29(33-24(22)26(28)31)20-6-4-3-5-7-20/h3-15,22-24H,2H2,1H3
InChIKey WNFITYMNYKCNAY-UHFFFAOYSA-N
Mol Weight 439.47 g/mol
Molecular Formula C26H21N3O4
Exact Mass 439.153206 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1skg2SzSjh2
Name 4-[5-(4-ethoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl]benzonitrile
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/C26H21N3O4/c1-2-32-21-14-12-19(13-15-21)28-25(30)22-23(18-10-8-17(16-27)9-11-18)29(33-24(22)26(28)31)20-6-4-3-5-7-20/h3-15,22-24H,2H2,1H3
InChIKey WNFITYMNYKCNAY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28669
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: D87000; Labnumber: VLM_NM-3024; SBI_ID: SBI-028673
Temperature 303 °C