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Ethyl 2-Cyano-2-(p-fluorophenyl)propanoate
SpectraBase Compound ID KrDfvwqNulL
InChI InChI=1S/C12H12FNO2/c1-3-16-11(15)12(2,8-14)9-4-6-10(13)7-5-9/h4-7H,3H2,1-2H3
InChIKey IJBIQPCVPIFHJP-UHFFFAOYSA-N
Mol Weight 221.23 g/mol
Molecular Formula C12H12FNO2
Exact Mass 221.085207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ixh4dDkM1lJ
Name Ethyl 2-Cyano-2-(p-fluorophenyl)propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C12H12FNO2
InChI InChI=1S/C12H12FNO2/c1-3-16-11(15)12(2,8-14)9-4-6-10(13)7-5-9/h4-7H,3H2,1-2H3
InChIKey IJBIQPCVPIFHJP-UHFFFAOYSA-N
Molecular Weight 221.231 g/mol
SMILES C(C(=O)OCC)(C#N)(c1ccc(cc1)F)C
SPLASH splash10-0002-0900000000-6e2d88f3ef500afc061a
Source of Spectrum B-44-369-0
Synonyms ethyl 2-cyano-2-(4-fluorophenyl)propanoate
Wiley ID 1221198