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N-(2'-Acetylethyl)-6-butyl-1,2,5,6-tetrahydropyridine-2-thione
SpectraBase Compound ID KsOhtCWhBDQ
InChI InChI=1S/C13H21NOS/c1-3-4-6-12-7-5-8-13(16)14(12)10-9-11(2)15/h5,8,12H,3-4,6-7,9-10H2,1-2H3
InChIKey JBUSKWHEMLSVDB-UHFFFAOYSA-N
Mol Weight 239.38 g/mol
Molecular Formula C13H21NOS
Exact Mass 239.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GiC5JKR4doB
Name N-(2'-Acetylethyl)-6-butyl-1,2,5,6-tetrahydropyridine-2-thione
Alternate Name(s) 4-(2-butyl-6-thioxo-3,6-dihydro-1(2H)-pyridinyl)-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NOS
InChI InChI=1S/C13H21NOS/c1-3-4-6-12-7-5-8-13(16)14(12)10-9-11(2)15/h5,8,12H,3-4,6-7,9-10H2,1-2H3
InChIKey JBUSKWHEMLSVDB-UHFFFAOYSA-N
Molecular Weight 239.377 g/mol
SMILES C1(N(C(CC=C1)CCCC)CCC(=O)C)=S
SPLASH splash10-03dj-2920000000-44952dbabdb3578cb04c
Source of Spectrum D1-2003-1676-3
Wiley ID 1548342