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3-Isobutyl-2-oxo-5-(2-phenylethyl)pyrrolidine
SpectraBase Compound ID 3ujnbrYKcQZ
InChI InChI=1S/C16H23NO/c1-12(2)10-14-11-15(17-16(14)18)9-8-13-6-4-3-5-7-13/h3-7,12,14-15H,8-11H2,1-2H3,(H,17,18)
InChIKey PWXNKJSSPSDBIF-UHFFFAOYSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9eebiulTmbe
Name 3-Isobutyl-2-oxo-5-(2-phenylethyl)pyrrolidine
Appearance White powder
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Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-12(2)10-14-11-15(17-16(14)18)9-8-13-6-4-3-5-7-13/h3-7,12,14-15H,8-11H2,1-2H3,(H,17,18)
InChIKey PWXNKJSSPSDBIF-UHFFFAOYSA-N
Instrument Name JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.9.161
Molecular Weight 245.366 g/mol
Reported Formula C16H23ON
SMILES N1C(CC(C1=O)CC(C)C)CCc1ccccc1
SPLASH splash10-000l-7910000000-547c1f7d84c329c19bf3
Sample Comments mixture of cis/trans (84:16)
Source of Spectrum BJO-9-SM3-2d
Wiley ID 1853712