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(3aS,7aR)-2-(4-((3aR,7aS)-4,7-dimethyl-1,3,5-trioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl)-4,7-dimethyltetrahydro-1H-4,7-methanoisoindole-1,3,5(2H,4H)-trione

View entire compound with spectra: 1 NMR

(3aS,7aR)-2-(4-((3aR,7aS)-4,7-dimethyl-1,3,5-trioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl)-4,7-dimethyltetrahydro-1H-4,7-methanoisoindole-1,3,5(2H,4H)-trione
SpectraBase Compound ID 99IVoWNfkZ1
InChI InChI=1S/C28H28N2O6/c1-25-9-15(31)27(3,11-25)19-17(25)21(33)29(23(19)35)13-5-7-14(8-6-13)30-22(34)18-20(24(30)36)28(4)12-26(18,2)10-16(28)32/h5-8,17-20H,9-12H2,1-4H3/t17-,18+,19+,20?,25+,26-,27+,28-/m1/s1
InChIKey NBVDVLCIMKDBOT-WCTHJVNMSA-N
Mol Weight 488.54 g/mol
Molecular Formula C28H28N2O6
Exact Mass 488.194737 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LXxvED5LTyh
Name (3aS,7aR)-2-(4-((3aR,7aS)-4,7-dimethyl-1,3,5-trioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl)-4,7-dimethyltetrahydro-1H-4,7-methanoisoindole-1,3,5(2H,4H)-trione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 488.194736624 u
Formula C28H28N2O6
InChI InChI=1S/C28H28N2O6/c1-25-9-15(31)27(3,11-25)19-17(25)21(33)29(23(19)35)13-5-7-14(8-6-13)30-22(34)18-20(24(30)36)28(4)12-26(18,2)10-16(28)32/h5-8,17-20H,9-12H2,1-4H3/t17-,18+,19+,20?,25+,26-,27+,28-/m1/s1
InChIKey NBVDVLCIMKDBOT-WCTHJVNMSA-N
Molecular Weight 488.540 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16714
Solvent DMSO-d6
Source Vendor ID: NMR/11250252; Lab Info: MMV; Lab Number: MMV-0104250