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(3aR,6aS)-3-(2,4-dichlorophenyl)-5-(4-nitrophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione
SpectraBase Compound ID EPKPWmUgpiL
InChI InChI=1S/C17H9Cl2N3O5/c18-8-1-6-11(12(19)7-8)14-13-15(27-20-14)17(24)21(16(13)23)9-2-4-10(5-3-9)22(25)26/h1-7,13,15H
InChIKey SDGHOJSHRSGDFO-UHFFFAOYSA-N
Mol Weight 406.18 g/mol
Molecular Formula C17H9Cl2N3O5
Exact Mass 404.991926 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 319xLw0TAQe
Name (3aR,6aS)-3-(2,4-dichlorophenyl)-5-(4-nitrophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-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/C17H9Cl2N3O5/c18-8-1-6-11(12(19)7-8)14-13-15(27-20-14)17(24)21(16(13)23)9-2-4-10(5-3-9)22(25)26/h1-7,13,15H
InChIKey SDGHOJSHRSGDFO-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6144
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: D13552; Labnumber: NNA-1206; SBI_ID: SBI-006147
Temperature 308 °C