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ethyl 4-((3aS,6R)-1-oxo-2-phenyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carbonyl)piperazine-1-carboxylate
SpectraBase Compound ID KbexqRn8KEl
InChI InChI=1S/C22H25N3O5/c1-2-29-21(28)24-12-10-23(11-13-24)19(26)17-16-8-9-22(30-16)14-25(20(27)18(17)22)15-6-4-3-5-7-15/h3-9,16-18H,2,10-14H2,1H3
InChIKey SFXVERHUKIUIFY-UHFFFAOYSA-N
Mol Weight 411.46 g/mol
Molecular Formula C22H25N3O5
Exact Mass 411.179421 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LcYtLS3uRcC
Name ethyl 4-((3aS,6R)-1-oxo-2-phenyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carbonyl)piperazine-1-carboxylate
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/C22H25N3O5/c1-2-29-21(28)24-12-10-23(11-13-24)19(26)17-16-8-9-22(30-16)14-25(20(27)18(17)22)15-6-4-3-5-7-15/h3-9,16-18H,2,10-14H2,1H3
InChIKey SFXVERHUKIUIFY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_74
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: F02678; Labnumber: ExLab-015657