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3-[4-(4-chlorobenzyl)piperazino]-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-quinone
SpectraBase Compound ID AIGWSVVDCyV
InChI InChI=1S/C22H21ClF3N3O3/c23-16-3-1-15(2-4-16)14-27-9-11-28(12-10-27)19-13-20(30)29(21(19)31)17-5-7-18(8-6-17)32-22(24,25)26/h1-8,19H,9-14H2
InChIKey YZOKDNPLBRUGAI-UHFFFAOYSA-N
Mol Weight 467.88 g/mol
Molecular Formula C22H21ClF3N3O3
Exact Mass 467.122354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CSrX24k3ohu
Name 3-[4-(4-chlorobenzyl)piperazino]-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21ClF3N3O3
InChI InChI=1S/C22H21ClF3N3O3/c23-16-3-1-15(2-4-16)14-27-9-11-28(12-10-27)19-13-20(30)29(21(19)31)17-5-7-18(8-6-17)32-22(24,25)26/h1-8,19H,9-14H2
InChIKey YZOKDNPLBRUGAI-UHFFFAOYSA-N
Molecular Weight 467.876 g/mol
SMILES c1cc(Cl)ccc1CN1CCN(C2C(N(C(C2)=O)c2ccc(OC(F)(F)F)cc2)=O)CC1
SPLASH splash10-004i-6921000000-44985e93f7946f56a0a0
Synonyms 3-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-dione 3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-dione 3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-1-[4-(trifluoromethyloxy)phenyl]pyrrolidine-2,5-dione
Wiley ID 1457909