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Cyclo-N,N'-[.alpha.,.apha'.-"para"-xylyl)-bis[indol-3-yl]-N-methylmaleimide
SpectraBase Compound ID Eb1CVbC6sT7
InChI InChI=1S/C29H21N3O2/c1-30-28(33)26-22-16-31(24-8-4-2-6-20(22)24)14-18-10-12-19(13-11-18)15-32-17-23(27(26)29(30)34)21-7-3-5-9-25(21)32/h2-13,16-17H,14-15H2,1H3
InChIKey UBFJNUTUFJVKKV-UHFFFAOYSA-N
Mol Weight 443.51 g/mol
Molecular Formula C29H21N3O2
Exact Mass 443.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GSxMO6Hu2id
Name Cyclo-N,N'-[.alpha.,.apha'.-''para''-xylyl)-bis[indol-3-yl]-N-methylmaleimide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.163376926 u
Formula C29H21N3O2
InChI InChI=1S/C29H21N3O2/c1-30-28(33)26-22-16-31(24-8-4-2-6-20(22)24)14-18-10-12-19(13-11-18)15-32-17-23(27(26)29(30)34)21-7-3-5-9-25(21)32/h2-13,16-17H,14-15H2,1H3
InChIKey UBFJNUTUFJVKKV-UHFFFAOYSA-N
Molecular Weight 443.506 g/mol
SMILES C12=C(C(=O)N(C2=O)C)C2=CN(CC3=CC=C(CN4C=C1C1=C4C=CC=C1)C=C3)C1=C2C=CC=C1