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

*Links on SpectraBase are not permalinks.

(2E)-2-butenedioic acid compound with N~1~-(2-furylmethyl)-N~2~,N~2~-dimethyl-N~1~-(2-pyridinyl)-1,2-ethanediamine (1:1)

View entire compound with spectra: 2 NMR

(2E)-2-butenedioic acid compound with N~1~-(2-furylmethyl)-N~2~,N~2~-dimethyl-N~1~-(2-pyridinyl)-1,2-ethanediamine (1:1)
SpectraBase Compound ID 9rFFTntCjaP
InChI InChI=1S/C14H19N3O.C4H4O4/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;5-3(6)1-2-4(7)8/h3-8,11H,9-10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey WSWXPPBXSUYAAC-WLHGVMLRSA-N
Mol Weight 361.4 g/mol
Molecular Formula C18H23N3O5
Exact Mass 361.163771 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 HfoshSR9XP7
Name (2E)-2-Butenedioic acid compound with N~1~-(2-furylmethyl)-N~2~,N~2~-dimethyl-N~1~-(2-pyridinyl)-1,2-ethanediamine (1:1)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.163770848 u
Formula C18H23N3O5
InChI InChI=1S/C14H19N3O.C4H4O4/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;5-3(6)1-2-4(7)8/h3-8,11H,9-10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey WSWXPPBXSUYAAC-WLHGVMLRSA-N
Molecular Weight 361.398 g/mol
SMILES OC(\C=C\C(=O)O)=O.C1=CC=C(N(CC=2OC=CC2)CCN(C)C)N=C1