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

*Links on SpectraBase are not permalinks.
3-(4-Chlorophenyl)-2-(diethylamino)-5-ethoxycarbonyl-6-methylfuro[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID L4z3RlS9sNS
InChI InChI=1S/C20H22ClN3O4/c1-5-23(6-2)20-22-17-16(15(12(4)28-17)19(26)27-7-3)18(25)24(20)14-10-8-13(21)9-11-14/h8-11H,5-7H2,1-4H3
InChIKey JWGDJAZUXDBUAP-UHFFFAOYSA-N
Mol Weight 403.87 g/mol
Molecular Formula C20H22ClN3O4
Exact Mass 403.129884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 3oJqWkdQM71
Name 3-(4-Chlorophenyl)-2-(diethylamino)-5-ethoxycarbonyl-6-methylfuro[2,3-d]pyrimidin-4(3H)-one
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22ClN3O4
InChI InChI=1S/C20H22ClN3O4/c1-5-23(6-2)20-22-17-16(15(12(4)28-17)19(26)27-7-3)18(25)24(20)14-10-8-13(21)9-11-14/h8-11H,5-7H2,1-4H3
InChIKey JWGDJAZUXDBUAP-UHFFFAOYSA-N
Instrument Name Finnigan Trace
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.d18
Molecular Weight 403.866 g/mol
SMILES c1(Cl)ccc(cc1)N1C(=Nc2c(C1=O)c(c(o2)C)C(=O)OCC)N(CC)CC
SPLASH splash10-0pb9-0962200000-4cf0fb252e2f702addeb
Source of Spectrum ARK-2008-155-6e
Wiley ID 1869109