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2-(Acridin-9-ylamino)-3-(1H-indol-3-yl)-propionic acid

View entire compound with spectra: 1 NMR

2-(Acridin-9-ylamino)-3-(1H-indol-3-yl)-propionic acid
SpectraBase Compound ID GbeS8O3P56W
InChI InChI=1S/C24H19N3O2/c28-24(29)22(13-15-14-25-19-10-4-1-7-16(15)19)27-23-17-8-2-5-11-20(17)26-21-12-6-3-9-18(21)23/h1-12,14,22,25H,13H2,(H,26,27)(H,28,29)
InChIKey KLTRUWFOTALXPO-UHFFFAOYSA-N
Mol Weight 381.44 g/mol
Molecular Formula C24H19N3O2
Exact Mass 381.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TPJHst5ZAi
Name 2-(Acridin-9-ylamino)-3-(1H-indol-3-yl)-propionic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.147726862 u
Formula C24H19N3O2
InChI InChI=1S/C24H19N3O2/c28-24(29)22(13-15-14-25-19-10-4-1-7-16(15)19)27-23-17-8-2-5-11-20(17)26-21-12-6-3-9-18(21)23/h1-12,14,22,25H,13H2,(H,26,27)(H,28,29)
InChIKey KLTRUWFOTALXPO-UHFFFAOYSA-N
Molecular Weight 381.435 g/mol
SMILES C1(NC(C(=O)O)CC2=CNC3=C2C=CC=C3)=C2C(=NC3=C1C=CC=C3)C=CC=C2