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1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-[3-(1H-indol-3-yl)-1-methylpropyl]-

View entire compound with spectra: 2 NMR

1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-[3-(1H-indol-3-yl)-1-methylpropyl]-
SpectraBase Compound ID FS9huFJcqHb
InChI InChI=1S/C20H22N2O2/c1-13(10-11-14-12-21-18-9-5-4-6-15(14)18)22-19(23)16-7-2-3-8-17(16)20(22)24/h2-6,9,12-13,16-17,21H,7-8,10-11H2,1H3
InChIKey LZZMRBXZYWSJBH-UHFFFAOYSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID euEufFignm
Name 1H-Isoindole-1,3(2H)-dione, 3A,4,7,7A-tetrahydro-2-[3-(1H-indol-3-yl)-1-methylpropyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.168127954 u
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-13(10-11-14-12-21-18-9-5-4-6-15(14)18)22-19(23)16-7-2-3-8-17(16)20(22)24/h2-6,9,12-13,16-17,21H,7-8,10-11H2,1H3
InChIKey LZZMRBXZYWSJBH-UHFFFAOYSA-N
SMILES N1C2=C(C(=C1)CCC(N1C(C3CC=CCC3C1=O)=O)C)C=CC=C2