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1-(1,3-dithian-2-yl)-3-keto-cyclohexanecarbonitrile
SpectraBase Compound ID 5ZqASwzjDw9
InChI InChI=1S/C11H15NOS2/c12-8-11(4-1-3-9(13)7-11)10-14-5-2-6-15-10/h10H,1-7H2
InChIKey ZYRUOTAIGGYYKU-UHFFFAOYSA-N
Mol Weight 241.37 g/mol
Molecular Formula C11H15NOS2
Exact Mass 241.059506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6yRQ9H4UAi
Name 1-(1,3-dithian-2-yl)-3-keto-cyclohexanecarbonitrile
Alternate Name(s) 1-(1,3-dithian-2-yl)-3-oxidanylidene-cyclohexane-1-carbonitrile 1-(1,3-dithian-2-yl)-3-oxo-1-cyclohexanecarbonitrile 1-(1,3-dithian-2-yl)-3-oxo-cyclohexanecarbonitrile 1-(1,3-dithian-2-yl)-3-oxocyclohexane-1-carbonitrile
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Formula C11H15NOS2
InChI InChI=1S/C11H15NOS2/c12-8-11(4-1-3-9(13)7-11)10-14-5-2-6-15-10/h10H,1-7H2
InChIKey ZYRUOTAIGGYYKU-UHFFFAOYSA-N
Molecular Weight 241.367 g/mol
SMILES C1(C2SCCCS2)(C#N)CC(=O)CCC1
SPLASH splash10-014l-7890000000-452d01f325c02443fdb7
Source of Spectrum J-61-4638-18
Wiley ID 1243901