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(3aR,6aS)-3-(4-fluorophenyl)-5-(2-methoxy-5-nitrophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione
SpectraBase Compound ID 1xxoBUw1Mbn
InChI InChI=1S/C18H12FN3O6/c1-27-13-7-6-11(22(25)26)8-12(13)21-17(23)14-15(20-28-16(14)18(21)24)9-2-4-10(19)5-3-9/h2-8,14,16H,1H3
InChIKey AMJOLWGKZJFKNW-UHFFFAOYSA-N
Mol Weight 385.31 g/mol
Molecular Formula C18H12FN3O6
Exact Mass 385.071013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID d1jH07d70y
Name (3aR,6aS)-3-(4-fluorophenyl)-5-(2-methoxy-5-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/C18H12FN3O6/c1-27-13-7-6-11(22(25)26)8-12(13)21-17(23)14-15(20-28-16(14)18(21)24)9-2-4-10(19)5-3-9/h2-8,14,16H,1H3
InChIKey AMJOLWGKZJFKNW-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14210
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: D97211; Labnumber: NNA05-617-1; SBI_ID: SBI-014213
Temperature 306 °C