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Malononitrile, 1-(4-t-butyl-1-cyclohexen-1-yl)-1-(1-cyclopenten-3-on-1-yl)-
SpectraBase Compound ID 5Ru8FXrDJj8
InChI InChI=1S/C18H22N2O/c1-17(2,3)13-4-6-14(7-5-13)18(11-19,12-20)15-8-9-16(21)10-15/h6,10,13H,4-5,7-9H2,1-3H3
InChIKey RWKQEQDRAKLHAL-UHFFFAOYSA-N
Mol Weight 282.39 g/mol
Molecular Formula C18H22N2O
Exact Mass 282.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50Gh1bZpiBz
Name Malononitrile, 1-(4-t-butyl-1-cyclohexen-1-yl)-1-(1-cyclopenten-3-on-1-yl)-
Alternate Name(s) 2-(4-tert-Butyl-1-cyclohexen-1-yl)-2-(3-oxo-1-cyclopenten-1-yl)malononitrile 2-(4-tert-butyl-1-cyclohexenyl)-2-(3-oxo-1-cyclopentenyl)propanedinitrile 2-(4-tert-butylcyclohexen-1-yl)-2-(3-ketocyclopenten-1-yl)malononitrile 2-(4-tert-butylcyclohexen-1-yl)-2-(3-oxidanylidenecyclopenten-1-yl)propanedinitrile 2-(4-tert-butylcyclohexen-1-yl)-2-(3-oxocyclopenten-1-yl)propanedinitrile
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Formula C18H22N2O
InChI InChI=1S/C18H22N2O/c1-17(2,3)13-4-6-14(7-5-13)18(11-19,12-20)15-8-9-16(21)10-15/h6,10,13H,4-5,7-9H2,1-3H3
InChIKey RWKQEQDRAKLHAL-UHFFFAOYSA-N
Molecular Weight 282.387 g/mol
SMILES C1(=O)C=C(CC1)C(C#N)(C#N)C1=CCC(CC1)C(C)(C)C
SPLASH splash10-0a6r-9350000000-ac98a3ea9be760436f8c
Wiley ID 1490566