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Acetic acid, 1-cyano-1-(cyclohexen-1-yl)-1-(3-oxocyclopent-1-en-1-yl)-, ethyl ester
SpectraBase Compound ID 5cGVsisMUW2
InChI InChI=1S/C16H19NO3/c1-2-20-15(19)16(11-17,12-6-4-3-5-7-12)13-8-9-14(18)10-13/h6,10H,2-5,7-9H2,1H3
InChIKey ALSSBMRYNNLQED-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QxxDexIgUl
Name Acetic acid, 1-cyano-1-(cyclohexen-1-yl)-1-(3-oxocyclopent-1-en-1-yl)-, ethyl ester
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Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-2-20-15(19)16(11-17,12-6-4-3-5-7-12)13-8-9-14(18)10-13/h6,10H,2-5,7-9H2,1H3
InChIKey ALSSBMRYNNLQED-UHFFFAOYSA-N
Molecular Weight 273.332 g/mol
SMILES C1(=O)C=C(CC1)C(C#N)(C1=CCCCC1)C(=O)OCC
SPLASH splash10-004i-8930000000-85dd161bf7fb59b0be97
Synonyms 2-cyano-2-(1-cyclohexenyl)-2-(3-oxo-1-cyclopentenyl)acetic acid ethyl ester 2-cyano-2-(cyclohexen-1-yl)-2-(3-ketocyclopenten-1-yl)acetic acid ethyl ester Ethyl 2-cyano-2-(cyclohexen-1-yl)-2-(3-oxidanylidenecyclopenten-1-yl)ethanoate Ethyl 2-cyano-2-(cyclohexen-1-yl)-2-(3-oxocyclopenten-1-yl)acetate Ethyl cyano(1-cyclohexen-1-yl)(3-oxo-1-cyclopenten-1-yl)acetate
Wiley ID 1501988