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

*Links on SpectraBase are not permalinks.

Diethyl {[2-(3'-indolyl)ethylamino]methylene}malonate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Diethyl {[2-(3'-indolyl)ethylamino]methylene}malonate
SpectraBase Compound ID BIrX60cXBYR
InChI InChI=1S/C18H22N2O4/c1-3-23-17(21)15(18(22)24-4-2)12-19-10-9-13-11-20-16-8-6-5-7-14(13)16/h5-8,11-12,19-20H,3-4,9-10H2,1-2H3
InChIKey KCZPVBJZMMCOEB-UHFFFAOYSA-N
Mol Weight 330.38 g/mol
Molecular Formula C18H22N2O4
Exact Mass 330.157957 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 C7l58g8uIJS
Name Diethyl {[2-(3'-indolyl)ethylamino]methylene}malonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.157957192 u
Formula C18H22N2O4
InChI InChI=1S/C18H22N2O4/c1-3-23-17(21)15(18(22)24-4-2)12-19-10-9-13-11-20-16-8-6-5-7-14(13)16/h5-8,11-12,19-20H,3-4,9-10H2,1-2H3
InChIKey KCZPVBJZMMCOEB-UHFFFAOYSA-N
Molecular Weight 330.384 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)=CNCCC1=CNC2=C1C=CC=C2