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2,5-Dimethylcinnamyl - nitrile

View entire compound with spectra: 1 MS (GC)

2,5-Dimethylcinnamyl - nitrile
SpectraBase Compound ID KIU9sgNoizW
InChI InChI=1S/C11H11N/c1-9-5-6-10(2)11(8-9)4-3-7-12/h3-6,8H,1-2H3/b4-3+
InChIKey WZGHBLONAABOSO-ONEGZZNKSA-N
Mol Weight 157.22 g/mol
Molecular Formula C11H11N
Exact Mass 157.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J150yZ6BAMW
Name 2,5-Dimethylcinnamyl - nitrile
Comments Less than 3 mono-isotopic peaks
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Formula C11H11N
InChI InChI=1S/C11H11N/c1-9-5-6-10(2)11(8-9)4-3-7-12/h3-6,8H,1-2H3/b4-3+
InChIKey WZGHBLONAABOSO-ONEGZZNKSA-N
Molecular Weight 157.216 g/mol
SMILES C(#N)\C=C\c1c(ccc(c1)C)C
SPLASH splash10-053r-0900000000-716d5b8ad8ce66799512
Source of Spectrum U-1995-1526-21
Synonyms (2E)-3-(2,5-dimethylphenyl)-2-propenenitrile (E)-3-(2,5-dimethylphenyl)-2-propenenitrile (E)-3-(2,5-dimethylphenyl)prop-2-enenitrile
Wiley ID 767308