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5-Oxobicyclo[4.2.0]octane-7-(exo)-carbonitrile
SpectraBase Compound ID J1RKw6Ap42e
InChI InChI=1S/C9H11NO/c10-5-7-4-6-2-1-3-8(11)9(6)7/h6-7,9H,1-4H2
InChIKey DPMWOVFMTQLNPZ-UHFFFAOYSA-N
Mol Weight 149.19 g/mol
Molecular Formula C9H11NO
Exact Mass 149.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdEG4pEdbu8
Name 5-Oxobicyclo[4.2.0]octane-7-(exo)-carbonitrile
Alternate Name(s) 5-oxobicyclo[4.2.0]octane-7-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C9H11NO
InChI InChI=1S/C9H11NO/c10-5-7-4-6-2-1-3-8(11)9(6)7/h6-7,9H,1-4H2
InChIKey DPMWOVFMTQLNPZ-UHFFFAOYSA-N
Molecular Weight 149.193 g/mol
SMILES C1(C2C(=O)CCCC2C1)C#N
SPLASH splash10-0a4i-9200000000-b35bed54fa41758fc872
Source of Spectrum I-81-420-3
Wiley ID 1517399