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(3aR,6aS)-3-(4-fluorophenyl)-5-(4-methoxybenzyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione
SpectraBase Compound ID KQV6OjfNEe5
InChI InChI=1S/C19H15FN2O4/c1-25-14-8-2-11(3-9-14)10-22-18(23)15-16(21-26-17(15)19(22)24)12-4-6-13(20)7-5-12/h2-9,15,17H,10H2,1H3
InChIKey VMSAHJGSAMXLGR-UHFFFAOYSA-N
Mol Weight 354.34 g/mol
Molecular Formula C19H15FN2O4
Exact Mass 354.101585 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 27KHFDJJLqf
Name (3aR,6aS)-3-(4-fluorophenyl)-5-(4-methoxybenzyl)-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/C19H15FN2O4/c1-25-14-8-2-11(3-9-14)10-22-18(23)15-16(21-26-17(15)19(22)24)12-4-6-13(20)7-5-12/h2-9,15,17H,10H2,1H3
InChIKey VMSAHJGSAMXLGR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27341
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: D76114; Labnumber: SC_0037-0197; SBI_ID: SBI-027345
Temperature 315 °C