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3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-
SpectraBase Compound ID 76wICXF7eb3
InChI InChI=1S/C18H11FN2O5/c19-10-3-1-9(2-4-10)15-14-16(26-20-15)18(23)21(17(14)22)11-5-6-12-13(7-11)25-8-24-12/h1-7,14,16H,8H2
InChIKey KIBXGEWYSNLPIT-UHFFFAOYSA-N
Mol Weight 354.29 g/mol
Molecular Formula C18H11FN2O5
Exact Mass 354.0652 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CY0RXqTnwBI
Name 3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-
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/C18H11FN2O5/c19-10-3-1-9(2-4-10)15-14-16(26-20-15)18(23)21(17(14)22)11-5-6-12-13(7-11)25-8-24-12/h1-7,14,16H,8H2
InChIKey KIBXGEWYSNLPIT-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7832
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: F31172; Labnumber: NNN-Z64376