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3-(2-Methylphenyl)pentanedinitrile
SpectraBase Compound ID J42pdYen1I4
InChI InChI=1S/C12H12N2/c1-10-4-2-3-5-12(10)11(6-8-13)7-9-14/h2-5,11H,6-7H2,1H3
InChIKey RIERCYIYNVQMIL-UHFFFAOYSA-N
Mol Weight 184.24 g/mol
Molecular Formula C12H12N2
Exact Mass 184.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GEnl41Frl9
Name 3-(2-Methylphenyl)pentanedinitrile
Comments Less than 3 mono-isotopic peaks
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Formula C12H12N2
InChI InChI=1S/C12H12N2/c1-10-4-2-3-5-12(10)11(6-8-13)7-9-14/h2-5,11H,6-7H2,1H3
InChIKey RIERCYIYNVQMIL-UHFFFAOYSA-N
Molecular Weight 184.242 g/mol
SMILES C(#N)CC(c1c(C)cccc1)CC#N
SPLASH splash10-0006-0900000000-5a0c31d76101ed935f13
Source of Spectrum QC-12-3371-1
Synonyms 3-(o-tolyl)glutaronitrile 3-(o-tolyl)pentanedinitrile
Wiley ID 1634959