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4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl]benzonitrile
SpectraBase Compound ID J2AyQfUoQL8
InChI InChI=1S/C24H16ClN3O3/c25-17-10-12-18(13-11-17)27-23(29)20-21(16-8-6-15(14-26)7-9-16)28(31-22(20)24(27)30)19-4-2-1-3-5-19/h1-13,20-22H
InChIKey KYALBPLGYULVJR-UHFFFAOYSA-N
Mol Weight 429.86 g/mol
Molecular Formula C24H16ClN3O3
Exact Mass 429.088019 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HRVUrkr57lg
Name 4-[5-(4-chlorophenyl)-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/C24H16ClN3O3/c25-17-10-12-18(13-11-17)27-23(29)20-21(16-8-6-15(14-26)7-9-16)28(31-22(20)24(27)30)19-4-2-1-3-5-19/h1-13,20-22H
InChIKey KYALBPLGYULVJR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28668
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: D86998; Labnumber: VLM_NM-3022; SBI_ID: SBI-028672
Temperature 303 °C