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1-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]-3-[2-(3,4-dimethoxyphenyl)ethylamino]pyrrolidine-2,5-dione
SpectraBase Compound ID 3gsEtRV7l1c
InChI InChI=1S/C21H21ClF2N2O5/c1-29-17-8-3-13(11-18(17)30-2)9-10-25-16-12-19(27)26(20(16)28)14-4-6-15(7-5-14)31-21(22,23)24/h3-8,11,16,25H,9-10,12H2,1-2H3
InChIKey FYOHAQQCFZOPDA-UHFFFAOYSA-N
Mol Weight 454.86 g/mol
Molecular Formula C21H21ClF2N2O5
Exact Mass 454.110706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L6dX9qumejt
Name 1-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]-3-[2-(3,4-dimethoxyphenyl)ethylamino]pyrrolidine-2,5-dione
Alternate Name(s) 1-[4-[chloro(difluoro)methoxy]phenyl]-3-(homoveratrylamino)pyrrolidine-2,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClF2N2O5
InChI InChI=1S/C21H21ClF2N2O5/c1-29-17-8-3-13(11-18(17)30-2)9-10-25-16-12-19(27)26(20(16)28)14-4-6-15(7-5-14)31-21(22,23)24/h3-8,11,16,25H,9-10,12H2,1-2H3
InChIKey FYOHAQQCFZOPDA-UHFFFAOYSA-N
Molecular Weight 454.858 g/mol
SMILES N(C1C(N(C(C1)=O)c1ccc(OC(F)(Cl)F)cc1)=O)CCc1cc(OC)c(cc1)OC
SPLASH splash10-0udi-2933000000-8dab4d29d236be9a725c
Wiley ID 1447996