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(3aS,6R)-1-oxo-N-phenyl-2-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
SpectraBase Compound ID 4claI3Xi5jA
InChI InChI=1S/C21H19N3O3/c25-19(23-15-4-2-1-3-5-15)17-16-6-9-21(27-16)13-24(20(26)18(17)21)12-14-7-10-22-11-8-14/h1-11,16-18H,12-13H2,(H,23,25)
InChIKey ZIBLVJPAVSRSNK-UHFFFAOYSA-N
Mol Weight 361.4 g/mol
Molecular Formula C21H19N3O3
Exact Mass 361.142641 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kw7AQkkw1Fd
Name (3aS,6R)-1-oxo-N-phenyl-2-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H19N3O3/c25-19(23-15-4-2-1-3-5-15)17-16-6-9-21(27-16)13-24(20(26)18(17)21)12-14-7-10-22-11-8-14/h1-11,16-18H,12-13H2,(H,23,25)
InChIKey ZIBLVJPAVSRSNK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_77
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: F02702; Labnumber: ExLab-016723