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1,3-Cyclopentadiene-1-butanenitrile, .alpha.,.alpha.-dimethyl-
SpectraBase Compound ID EkTLPwsN0cD
InChI InChI=1S/C11H15N/c1-11(2,9-12)8-7-10-5-3-4-6-10/h3-5H,6-8H2,1-2H3
InChIKey KAVYAINJLZOERF-UHFFFAOYSA-N
Mol Weight 161.25 g/mol
Molecular Formula C11H15N
Exact Mass 161.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJdhQFbKdew
Name 1,3-Cyclopentadiene-1-butanenitrile, .alpha.,.alpha.-dimethyl-
Alternate Name(s) 4-(1,3-cyclopentadien-1-yl)-2,2-dimethylbutanenitrile 4-(1,3/2,5-cyclopentadien-1-yl)-2,2-dimethyl-butyronitrile
CAS Registry Number 81378-16-7
Comments Less than 3 mono-isotopic peaks
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Formula C11H15N
InChI InChI=1S/C11H15N/c1-11(2,9-12)8-7-10-5-3-4-6-10/h3-5H,6-8H2,1-2H3
InChIKey KAVYAINJLZOERF-UHFFFAOYSA-N
Molecular Weight 161.248 g/mol
SMILES C(#N)C(CCC1=CC=CC1)(C)C
SPLASH splash10-004i-9200000000-6a08168a3596f908bf33
Source of Spectrum K-115-472-0
Wiley ID 1157876