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

*Links on SpectraBase are not permalinks.
1-(3-Chlorophenyl)-3-[4-(2-fluorobenzoyl)piperazino]pyrrolidine-2,5-quinone
SpectraBase Compound ID 3z5iW4JwCiA
InChI InChI=1S/C21H19ClFN3O3/c22-14-4-3-5-15(12-14)26-19(27)13-18(21(26)29)24-8-10-25(11-9-24)20(28)16-6-1-2-7-17(16)23/h1-7,12,18H,8-11,13H2
InChIKey VXKFBROEEAVJCQ-UHFFFAOYSA-N
Mol Weight 415.85 g/mol
Molecular Formula C21H19ClFN3O3
Exact Mass 415.109897 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 DCQI1XbWuXN
Name 1-(3-Chlorophenyl)-3-[4-(2-fluorobenzoyl)piperazino]pyrrolidine-2,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19ClFN3O3
InChI InChI=1S/C21H19ClFN3O3/c22-14-4-3-5-15(12-14)26-19(27)13-18(21(26)29)24-8-10-25(11-9-24)20(28)16-6-1-2-7-17(16)23/h1-7,12,18H,8-11,13H2
InChIKey VXKFBROEEAVJCQ-UHFFFAOYSA-N
Molecular Weight 415.852 g/mol
SMILES c1ccc(C(N2CCN(C3C(N(C(C3)=O)c3cc(Cl)ccc3)=O)CC2)=O)c(F)c1
SPLASH splash10-05fr-9510000000-191f5e408e6b4ab12b0d
Synonyms 1-(3-Chlorophenyl)-3-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]pyrrolidine-2,5-dione 1-(3-Chlorophenyl)-3-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]pyrrolidine-2,5-dione
Wiley ID 1457900