For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-1H-indol-5-yl cyclopropanecarboxylate
SpectraBase Compound ID C4gN50aJdqx
InChI InChI=1S/C22H18N2O4/c25-20-16-3-1-2-4-17(16)21(26)24(20)10-9-14-12-23-19-8-7-15(11-18(14)19)28-22(27)13-5-6-13/h1-4,7-8,11-13,23H,5-6,9-10H2
InChIKey YSLZTUBQVGKFFU-UHFFFAOYSA-N
Mol Weight 374.4 g/mol
Molecular Formula C22H18N2O4
Exact Mass 374.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DrUZePQ98KI
Name 3-[2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-1H-indol-5-yl cyclopropanecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.126657064 u
Formula C22H18N2O4
InChI InChI=1S/C22H18N2O4/c25-20-16-3-1-2-4-17(16)21(26)24(20)10-9-14-12-23-19-8-7-15(11-18(14)19)28-22(27)13-5-6-13/h1-4,7-8,11-13,23H,5-6,9-10H2
InChIKey YSLZTUBQVGKFFU-UHFFFAOYSA-N
Molecular Weight 374.396 g/mol
SMILES N1C2=C(C(=C1)CCN1C(C=3C=CC=CC3C1=O)=O)C=C(C=C2)OC(C1CC1)=O