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2-Chloro-2-cyano-(E)-3,4-diethylcyclobutanone
SpectraBase Compound ID KWmPFyaTPtg
InChI InChI=1S/C9H12ClNO/c1-3-6-7(4-2)9(10,5-11)8(6)12/h6-7H,3-4H2,1-2H3
InChIKey CTTWEUDIJTXTTN-UHFFFAOYSA-N
Mol Weight 185.65 g/mol
Molecular Formula C9H12ClNO
Exact Mass 185.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LieKFjgq4e9
Name 2-Chloro-2-cyano-(E)-3,4-diethylcyclobutanone
CAS Registry Number 90024-44-5
Comments Less than 3 mono-isotopic peaks
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Formula C9H12ClNO
InChI InChI=1S/C9H12ClNO/c1-3-6-7(4-2)9(10,5-11)8(6)12/h6-7H,3-4H2,1-2H3
InChIKey CTTWEUDIJTXTTN-UHFFFAOYSA-N
Molecular Weight 185.654 g/mol
SMILES C1(C(=O)C(C1CC)CC)(C#N)Cl
SPLASH splash10-00di-9100000000-21415c57a9f169b76b65
Source of Spectrum J-49-2193-0
Synonyms 1-chloro-2,3-diethyl-4-oxocyclobutanecarbonitrile
Wiley ID 1181797