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Benzeneacetonitrile, alpha,alpha,4-trimethyl-2-methyl-2-p-tolylpropionitrile
SpectraBase Compound ID 9uKotf3fD51
InChI InChI=1S/C11H13N/c1-9-4-6-10(7-5-9)11(2,3)8-12/h4-7H,1-3H3
InChIKey VCSBTPVGIGROGB-UHFFFAOYSA-N
Mol Weight 159.23 g/mol
Molecular Formula C11H13N
Exact Mass 159.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEqdDk5w0Zs
Name 2-methyl-2-(4-methylphenyl)propanenitrile
CAS Registry Number 40119-34-4
Comments Less than 3 mono-isotopic peaks
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Formula C11H13N
InChI InChI=1S/C11H13N/c1-9-4-6-10(7-5-9)11(2,3)8-12/h4-7H,1-3H3
InChIKey VCSBTPVGIGROGB-UHFFFAOYSA-N
Molecular Weight 159.232 g/mol
SMILES C(#N)C(c1ccc(cc1)C)(C)C
SPLASH splash10-052f-9700000000-68aa00e71a13e1e68845
Source of Spectrum J-44-858-0
Synonyms 2-methyl-2-(p-tolyl)propanenitrile 2-methyl-2-(p-tolyl)propionitrile
Wiley ID 1156311