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2-cyano-2-(3-ketocyclopenten-1-yl)-2-(7-oxabicyclo[4.1.0]heptan-6-yl)acetic acid ethyl ester
SpectraBase Compound ID CtZEP2UZAjw
InChI InChI=1S/C16H19NO4/c1-2-20-14(19)15(10-17,11-6-7-12(18)9-11)16-8-4-3-5-13(16)21-16/h9,13H,2-8H2,1H3
InChIKey SFLMPEYCLRACQW-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOfEfCNKz20
Name 2-cyano-2-(3-ketocyclopenten-1-yl)-2-(7-oxabicyclo[4.1.0]heptan-6-yl)acetic acid ethyl ester
Alternate Name(s) 2-cyano-2-(7-oxabicyclo[4.1.0]heptan-6-yl)-2-(3-oxo-1-cyclopentenyl)acetic acid ethyl ester Acetic acid, 1-cyano-1-(cyclohexen-1,2-oxide-1-yl)-1-(3-oxocyclopent-1-en-1-yl)-, ethyl ester Ethyl 2-cyano-2-(7-oxabicyclo[4.1.0]heptan-6-yl)-2-(3-oxidanylidenecyclopenten-1-yl)ethanoate Ethyl 2-cyano-2-(7-oxabicyclo[4.1.0]heptan-6-yl)-2-(3-oxocyclopenten-1-yl)acetate Ethyl cyano(7-oxabicyclo[4.1.0]hept-1-yl)(3-oxo-1-cyclopenten-1-yl)acetate
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Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-2-20-14(19)15(10-17,11-6-7-12(18)9-11)16-8-4-3-5-13(16)21-16/h9,13H,2-8H2,1H3
InChIKey SFLMPEYCLRACQW-UHFFFAOYSA-N
Molecular Weight 289.331 g/mol
SMILES C(=O)(C(C12CCCCC2O1)(C1=CC(CC1)=O)C#N)OCC
SPLASH splash10-004l-9400000000-7178e854748da7f46013
Wiley ID 1501989