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3(E)-[(Hexylsulfanyl)methylene]-1-isobutyl-2-piperidinone
SpectraBase Compound ID GgDlVUMvryh
InChI InChI=1S/C16H29NOS/c1-4-5-6-7-11-19-13-15-9-8-10-17(16(15)18)12-14(2)3/h13-14H,4-12H2,1-3H3/b15-13+
InChIKey CDXMHWGZYMAOTD-FYWRMAATSA-N
Mol Weight 283.47 g/mol
Molecular Formula C16H29NOS
Exact Mass 283.196986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgUWFqh9mc5
Name 3(E)-[(Hexylsulfanyl)methylene]-1-isobutyl-2-piperidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29NOS
InChI InChI=1S/C16H29NOS/c1-4-5-6-7-11-19-13-15-9-8-10-17(16(15)18)12-14(2)3/h13-14H,4-12H2,1-3H3/b15-13+
InChIKey CDXMHWGZYMAOTD-FYWRMAATSA-N
Molecular Weight 283.474 g/mol
SMILES C1(N(CC(C)C)CCC\C1=C\SCCCCCC)=O
SPLASH splash10-052g-4970000000-5ebb83bc81eced3be51a
Source of Spectrum F5-1-4266-3e
Synonyms (E)-3-((hexylthio)methylene)-1-isobutylpiperidin-2-one (3E)-3-[(hexylthio)methylidene]-1-(2-methylpropyl)-2-piperidinone (3E)-3-(hexylsulfanylmethylene)-1-isobutyl-piperidin-2-one (3E)-3-(hexylsulfanylmethylidene)-1-(2-methylpropyl)piperidin-2-one
Wiley ID 1731597