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3-[4-(1-adamantyl)-1-piperazinyl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
SpectraBase Compound ID Brw9wEnIzZl
InChI InChI=1S/C25H33N3O3/c1-31-21-4-2-20(3-5-21)28-23(29)13-22(24(28)30)26-6-8-27(9-7-26)25-14-17-10-18(15-25)12-19(11-17)16-25/h2-5,17-19,22H,6-16H2,1H3/t17-,18+,19-,22?,25-
InChIKey RBRSSJNVUQAOGH-DUWCAJDJSA-N
Mol Weight 423.6 g/mol
Molecular Formula C25H33N3O3
Exact Mass 423.252192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ksHxDGrCPp
Name 3-[4-(1-adamantyl)-1-piperazinyl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H33N3O3
InChI InChI=1S/C25H33N3O3/c1-31-21-4-2-20(3-5-21)28-23(29)13-22(24(28)30)26-6-8-27(9-7-26)25-14-17-10-18(15-25)12-19(11-17)16-25/h2-5,17-19,22H,6-16H2,1H3/t17-,18+,19-,22?,25-
InChIKey RBRSSJNVUQAOGH-DUWCAJDJSA-N
Molecular Weight 423.557 g/mol
SMILES COc1ccc(N2C(C(N3CCN(C45C[C@]6(C[C@@](C5)(C[C@@](C4)(C6)[H])[H])[H])CC3)CC2=O)=O)cc1
SPLASH splash10-00dr-3861900000-92f5f765533771a37d41
Synonyms 3-[4-(1-adamantyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione 3-[4-(1-adamantyl)piperazino]-1-(4-methoxyphenyl)pyrrolidine-2,5-quinone
Wiley ID 1463380