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6-(4-Benzylpiperidin-1-yl)-4-chloro-2-phenyl-2,5-diazabicyclo[2.2.2]oct-5-en-3-one

View entire compound with spectra: 1 MS (GC)

6-(4-Benzylpiperidin-1-yl)-4-chloro-2-phenyl-2,5-diazabicyclo[2.2.2]oct-5-en-3-one
SpectraBase Compound ID IWUqX1stE7d
InChI InChI=1S/C24H26ClN3O/c25-24-14-11-21(28(23(24)29)20-9-5-2-6-10-20)22(26-24)27-15-12-19(13-16-27)17-18-7-3-1-4-8-18/h1-10,19,21H,11-17H2
InChIKey ACXOSZRBADBQRD-UHFFFAOYSA-N
Mol Weight 407.95 g/mol
Molecular Formula C24H26ClN3O
Exact Mass 407.17644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOE49Pumzmd
Name 6-(4-Benzylpiperidin-1-yl)-4-chloro-2-phenyl-2,5-diazabicyclo[2.2.2]oct-5-en-3-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26ClN3O
InChI InChI=1S/C24H26ClN3O/c25-24-14-11-21(28(23(24)29)20-9-5-2-6-10-20)22(26-24)27-15-12-19(13-16-27)17-18-7-3-1-4-8-18/h1-10,19,21H,11-17H2
InChIKey ACXOSZRBADBQRD-UHFFFAOYSA-N
Molecular Weight 407.945 g/mol
SMILES C1(=NC2(C(N(C1CC2)c1ccccc1)=O)Cl)N1CCC(Cc2ccccc2)CC1
SPLASH splash10-000l-5090100000-2623d858b24f3ab7a659
Source of Spectrum F-47-9277-9
Synonyms 6-(4-benzyl-1-piperidinyl)-4-chloro-2-phenyl-2,5-diazabicyclo[2.2.2]oct-5-en-3-one
Wiley ID 1372607