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(2R,6S)-1-benzoyl-2-(3-ketopentyl)-6-propyl-3-piperidone
SpectraBase Compound ID Jm9G8iH97RT
InChI InChI=1S/C20H27NO3/c1-3-8-16-11-14-19(23)18(13-12-17(22)4-2)21(16)20(24)15-9-6-5-7-10-15/h5-7,9-10,16,18H,3-4,8,11-14H2,1-2H3/t16-,18+/m0/s1
InChIKey GRCIQTJJBAQEPI-FUHWJXTLSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6u5U3u37Cs
Name (2R,6S)-1-benzoyl-2-(3-ketopentyl)-6-propyl-3-piperidone
Alternate Name(s) (2R,6S)-1-benzoyl-2-(3-oxopentyl)-6-propyl-3-piperidinone (2R,6S)-2-(3-oxidanylidenepentyl)-1-(phenylcarbonyl)-6-propyl-piperidin-3-one (2R,6S)-1-benzoyl-2-(3-oxopentyl)-6-propylpiperidin-3-one
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Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-3-8-16-11-14-19(23)18(13-12-17(22)4-2)21(16)20(24)15-9-6-5-7-10-15/h5-7,9-10,16,18H,3-4,8,11-14H2,1-2H3/t16-,18+/m0/s1
InChIKey GRCIQTJJBAQEPI-FUHWJXTLSA-N
Molecular Weight 329.440 g/mol
SMILES C(N1[C@@](C(=O)CC[C@@]1(CCC)[H])(CCC(=O)CC)[H])(=O)c1ccccc1
SPLASH splash10-0a4i-3911000000-5e6e4142bfb6e54ca610
Source of Spectrum KC-0-1122-31
Wiley ID 785672