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2,4-Cyclopentadiene-1-carbonitrile, 1,2-dimethyl-
SpectraBase Compound ID EwkAOlDmx90
InChI InChI=1S/C8H9N/c1-7-4-3-5-8(7,2)6-9/h3-5H,1-2H3
InChIKey JCWACGMZQFCPBA-UHFFFAOYSA-N
Mol Weight 119.17 g/mol
Molecular Formula C8H9N
Exact Mass 119.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqZ2xFobxR3
Name 2,4-Cyclopentadiene-1-carbonitrile, 1,2-dimethyl-
Alternate Name(s) 1,2-dimethyl-2,4-cyclopentadiene-1-carbonitrile 1,5-Dimethyl-1,3-cyclopentadiene-5-carbonitrile
CAS Registry Number 84883-91-0
Comments Less than 3 mono-isotopic peaks
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Formula C8H9N
InChI InChI=1S/C8H9N/c1-7-4-3-5-8(7,2)6-9/h3-5H,1-2H3
InChIKey JCWACGMZQFCPBA-UHFFFAOYSA-N
Molecular Weight 119.167 g/mol
SMILES C1(C(=CC=C1)C)(C#N)C
SPLASH splash10-0udi-0900000000-10ff855cd8d31c6a43a6
Source of Spectrum K-116-313-0
Wiley ID 1126898