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1-{2-[5-(benzyloxy)-1H-indol-3-yl]ethyl}-3-methyl-1H-pyrrole-2,5-dione
SpectraBase Compound ID 4ZIpJjpNXuP
InChI InChI=1S/C22H20N2O3/c1-15-11-21(25)24(22(15)26)10-9-17-13-23-20-8-7-18(12-19(17)20)27-14-16-5-3-2-4-6-16/h2-8,11-13,23H,9-10,14H2,1H3
InChIKey ATHHFMDHJPDGJV-UHFFFAOYSA-N
Mol Weight 360.41 g/mol
Molecular Formula C22H20N2O3
Exact Mass 360.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5dUHVzUGoKa
Name 1-{2-[5-(Benzyloxy)-1H-indol-3-yl]ethyl}-3-methyl-1H-pyrrole-2,5-dione
Comments Computed using HOSE algorithm
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Exact Mass 360.147392509 u
Formula C22H20N2O3
InChI InChI=1S/C22H20N2O3/c1-15-11-21(25)24(22(15)26)10-9-17-13-23-20-8-7-18(12-19(17)20)27-14-16-5-3-2-4-6-16/h2-8,11-13,23H,9-10,14H2,1H3
InChIKey ATHHFMDHJPDGJV-UHFFFAOYSA-N
Molecular Weight 360.413 g/mol
SMILES N1C2=C(C(=C1)CCN1C(C(C)=CC1=O)=O)C=C(C=C2)OCC=1C=CC=CC1