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4-(2'-Oxo-3'-methylcyclopentyl)-4-methylpentanenitrile
SpectraBase Compound ID 3TnrikBd6WW
InChI InChI=1S/C12H19NO/c1-9-5-6-10(11(9)14)12(2,3)7-4-8-13/h9-10H,4-7H2,1-3H3
InChIKey CMYIOGKYZUMVLE-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 1pRSChZF5M
Name 4-(2'-Oxo-3'-methylcyclopentyl)-4-methylpentanenitrile
Alternate Name(s) (cis)-4-(2'-Oxo-3'-methylcyclopentyl)-4-methylpentanenitrile (trans)-4-(2'-Oxo-3'-methylcyclopentyl)-4-methylpentanenitrile 4-Methyl-4-(3-methyl-2-oxocyclopentyl)pentanenitrile
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Formula C12H19NO
InChI InChI=1S/C12H19NO/c1-9-5-6-10(11(9)14)12(2,3)7-4-8-13/h9-10H,4-7H2,1-3H3
InChIKey CMYIOGKYZUMVLE-UHFFFAOYSA-N
Molecular Weight 193.290 g/mol
SMILES C1(C(CCC1C)C(CCC#N)(C)C)=O
SPLASH splash10-00mk-9400000000-69782676aabce2a83a54
Source of Spectrum D1-1995-1251-2
Wiley ID 834606