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2-(4-Chloro-phenyl)-1,4-dipyrrolidin-1-yl-butane-1,4-dione
SpectraBase Compound ID BlRkHUyQqJA
InChI InChI=1S/C18H23ClN2O2/c19-15-7-5-14(6-8-15)16(18(23)21-11-3-4-12-21)13-17(22)20-9-1-2-10-20/h5-8,16H,1-4,9-13H2
InChIKey BBNJTHBHSLCOOM-UHFFFAOYSA-N
Mol Weight 334.85 g/mol
Molecular Formula C18H23ClN2O2
Exact Mass 334.144806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xin04FVZX6
Name 2-(4-Chloro-phenyl)-1,4-dipyrrolidin-1-yl-butane-1,4-dione
Alternate Name(s) 2-(4-Chlorophenyl)-1,4-di(pyrrolidin-1-yl)butane-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23ClN2O2
InChI InChI=1S/C18H23ClN2O2/c19-15-7-5-14(6-8-15)16(18(23)21-11-3-4-12-21)13-17(22)20-9-1-2-10-20/h5-8,16H,1-4,9-13H2
InChIKey BBNJTHBHSLCOOM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200600466
Molecular Weight 334.847 g/mol
SMILES C(C(CC(=O)N1CCCC1)c1ccc(cc1)Cl)(=O)N1CCCC1
SPLASH splash10-06y2-9231000000-8dbd0e6871645ccee13e
Source of Spectrum ASC-349-849/SM3-3ca
Wiley ID 1765560