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(3aS,6R)-N-(4-methoxyphenyl)-1-oxo-2-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
SpectraBase Compound ID CIhT4eT1hX3
InChI InChI=1S/C22H21N3O4/c1-28-16-4-2-15(3-5-16)24-20(26)18-17-6-9-22(29-17)13-25(21(27)19(18)22)12-14-7-10-23-11-8-14/h2-11,17-19H,12-13H2,1H3,(H,24,26)
InChIKey JVBBGGROWIQFHM-UHFFFAOYSA-N
Mol Weight 391.43 g/mol
Molecular Formula C22H21N3O4
Exact Mass 391.153206 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5TPLQLw8RMf
Name (3aS,6R)-N-(4-methoxyphenyl)-1-oxo-2-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H21N3O4/c1-28-16-4-2-15(3-5-16)24-20(26)18-17-6-9-22(29-17)13-25(21(27)19(18)22)12-14-7-10-23-11-8-14/h2-11,17-19H,12-13H2,1H3,(H,24,26)
InChIKey JVBBGGROWIQFHM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_630
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: F04844; Labnumber: ExLab-016777