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

*Links on SpectraBase are not permalinks.
METHYL-4-[(4,4-DICYANO-2-METHOXYCARBONYLBUTYL)-METHYLAMINO]-BENZOATE
SpectraBase Compound ID 4SbvH6afjiA
InChI InChI=1S/C17H19N3O4/c1-20(15-6-4-13(5-7-15)16(21)23-2)11-14(17(22)24-3)8-12(9-18)10-19/h4-7,12,14H,8,11H2,1-3H3
InChIKey NMNULRSUSXFBHW-UHFFFAOYSA-N
Mol Weight 329.36 g/mol
Molecular Formula C17H19N3O4
Exact Mass 329.137556 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 AaRH2AMtA3q
Name METHYL-4-[(4,4-DICYANO-2-METHOXYCARBONYLBUTYL)-METHYLAMINO]-BENZOATE
Compound Number 14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19N3O4
InChI InChI=1S/C17H19N3O4/c1-20(15-6-4-13(5-7-15)16(21)23-2)11-14(17(22)24-3)8-12(9-18)10-19/h4-7,12,14H,8,11H2,1-3H3
InChIKey NMNULRSUSXFBHW-UHFFFAOYSA-N
Literature Reference Author J.I.BORRELL,J.TEIXIDO,J.L.MATALLANA,B.MARTINEZ-TEIPEL,C.COLO MINAS,M.COSTA,M.BALC
Literature Reference Citation J.MED.CHEM.,44,2366(2001)
Literature Reference DOI 10.1021/jm990411u
Molecular Weight 329.356 g/mol
Sample ID 44625
Solvent CDCl3