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3-[4-(1-adamantyl)-1-piperazinyl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione
SpectraBase Compound ID EuIb3WuTxxB
InChI InChI=1S/C24H30ClN3O2/c25-19-2-1-3-20(11-19)28-22(29)12-21(23(28)30)26-4-6-27(7-5-26)24-13-16-8-17(14-24)10-18(9-16)15-24/h1-3,11,16-18,21H,4-10,12-15H2/t16-,17+,18-,21?,24-
InChIKey DBEPJJYQQWIPPP-PMXPDCCXSA-N
Mol Weight 427.98 g/mol
Molecular Formula C24H30ClN3O2
Exact Mass 427.202655 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnqRzOlKKMy
Name 3-[4-(1-adamantyl)-1-piperazinyl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione
Alternate Name(s) 3-[4-(1-adamantyl)piperazin-1-yl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione 3-[4-(1-adamantyl)piperazino]-1-(3-chlorophenyl)pyrrolidine-2,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30ClN3O2
InChI InChI=1S/C24H30ClN3O2/c25-19-2-1-3-20(11-19)28-22(29)12-21(23(28)30)26-4-6-27(7-5-26)24-13-16-8-17(14-24)10-18(9-16)15-24/h1-3,11,16-18,21H,4-10,12-15H2/t16-,17+,18-,21?,24-
InChIKey DBEPJJYQQWIPPP-PMXPDCCXSA-N
Molecular Weight 427.976 g/mol
SMILES c1ccc(N2C(C(N3CCN(C45C[C@]6(C[C@@](C5)(C[C@@](C4)(C6)[H])[H])[H])CC3)CC2=O)=O)cc1Cl
SPLASH splash10-000i-5910000000-b83f1c97f723e29daa6f
Wiley ID 1463565