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(3aR,6aS)-5-benzyl-3-(4-fluorophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione

View entire compound with spectra: 1 NMR

(3aR,6aS)-5-benzyl-3-(4-fluorophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione
SpectraBase Compound ID J2k6cLAlKFD
InChI InChI=1S/C18H13FN2O3/c19-13-8-6-12(7-9-13)15-14-16(24-20-15)18(23)21(17(14)22)10-11-4-2-1-3-5-11/h1-9,14,16H,10H2
InChIKey YESRZUNGJBNCHD-UHFFFAOYSA-N
Mol Weight 324.31 g/mol
Molecular Formula C18H13FN2O3
Exact Mass 324.09102 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2MAlLxi5BFn
Name (3aR,6aS)-5-benzyl-3-(4-fluorophenyl)-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/C18H13FN2O3/c19-13-8-6-12(7-9-13)15-14-16(24-20-15)18(23)21(17(14)22)10-11-4-2-1-3-5-11/h1-9,14,16H,10H2
InChIKey YESRZUNGJBNCHD-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27331
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: D76099; Labnumber: SC_0037-0182; SBI_ID: SBI-027335
Temperature 315 °C