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2-(3,5,5-trimethyl-3-oxidanyl-cyclohexen-1-yl)propanenitrile
SpectraBase Compound ID E2Nno2CwTna
InChI InChI=1S/C12H19NO/c1-9(7-13)10-5-11(2,3)8-12(4,14)6-10/h6,9,14H,5,8H2,1-4H3
InChIKey KLFJLSIWZXAUNQ-UHFFFAOYSA-N
Mol Weight 193.29 g/mol
Molecular Formula C12H19NO
Exact Mass 193.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0WRg1BEw90
Name 2-(3,5,5-trimethyl-3-oxidanyl-cyclohexen-1-yl)propanenitrile
Alternate Name(s) 2-(3-hydroxy-3,5,5-trimethyl-1-cyclohexenyl)propanenitrile 2-(3-hydroxy-3,5,5-trimethyl-cyclohexen-1-yl)propanenitrile 2-(3-hydroxy-3,5,5-trimethyl-cyclohexen-1-yl)propionitrile
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Formula C12H19NO
InChI InChI=1S/C12H19NO/c1-9(7-13)10-5-11(2,3)8-12(4,14)6-10/h6,9,14H,5,8H2,1-4H3
InChIKey KLFJLSIWZXAUNQ-UHFFFAOYSA-N
Molecular Weight 193.290 g/mol
SMILES OC1(C=C(CC(C1)(C)C)C(C#N)C)C
SPLASH splash10-004i-1900000000-3bbdc984c59af7157f93
Source of Spectrum K-2002-1596-15
Wiley ID 1612884