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N-Butyl-4-(1',3'-dioxo-1',3'-dihydroisoindol-2'-yl)-3-(1H-indol-3"-yl)-butyramide

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N-Butyl-4-(1',3'-dioxo-1',3'-dihydroisoindol-2'-yl)-3-(1H-indol-3"-yl)-butyramide
SpectraBase Compound ID H8BA6lCcpt9
InChI InChI=1S/C24H25N3O3/c1-2-3-12-25-22(28)13-16(20-14-26-21-11-7-6-8-17(20)21)15-27-23(29)18-9-4-5-10-19(18)24(27)30/h4-11,14,16,26H,2-3,12-13,15H2,1H3,(H,25,28)
InChIKey ADJPBBLCONREKS-UHFFFAOYSA-N
Mol Weight 403.48 g/mol
Molecular Formula C24H25N3O3
Exact Mass 403.189592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Do41jWY3oRf
Name N-Butyl-4-(1',3'-dioxo-1',3'-dihydroisoindol-2'-yl)-3-(1H-indol-3''-yl)-butyramide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.189591674 u
Formula C24H25N3O3
InChI InChI=1S/C24H25N3O3/c1-2-3-12-25-22(28)13-16(20-14-26-21-11-7-6-8-17(20)21)15-27-23(29)18-9-4-5-10-19(18)24(27)30/h4-11,14,16,26H,2-3,12-13,15H2,1H3,(H,25,28)
InChIKey ADJPBBLCONREKS-UHFFFAOYSA-N
Molecular Weight 403.482 g/mol
SMILES C1(N(C(C=2C=CC=CC12)=O)CC(C1=CNC2=C1C=CC=C2)CC(=O)NCCCC)=O