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2-Fluoro-3-hydroxy-3-(3-methylphenyl)propanoic acid ethyl ester
SpectraBase Compound ID nyH8ot0itQ
InChI InChI=1S/C12H15FO3/c1-3-16-12(15)10(13)11(14)9-6-4-5-8(2)7-9/h4-7,10-11,14H,3H2,1-2H3
InChIKey ISFLUQNJHIQHAS-UHFFFAOYSA-N
Mol Weight 226.25 g/mol
Molecular Formula C12H15FO3
Exact Mass 226.100523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HskgmzAh6j
Name 2-Fluoro-3-hydroxy-3-(3-methylphenyl)propanoic acid ethyl ester
Alternate Name(s) 2-Fluoro-3-hydroxy-3-(m-tolyl)propionic acid ethyl ester Ethyl 2-fluoranyl-3-(3-methylphenyl)-3-oxidanyl-propanoate Ethyl 2-fluoro-3-hydroxy-3-(3-methylphenyl)propanoate Ethyl 2-fluoro-3-hydroxy-3-(m-tolyl)propanoate
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Formula C12H15FO3
InChI InChI=1S/C12H15FO3/c1-3-16-12(15)10(13)11(14)9-6-4-5-8(2)7-9/h4-7,10-11,14H,3H2,1-2H3
InChIKey ISFLUQNJHIQHAS-UHFFFAOYSA-N
Molecular Weight 226.247 g/mol
SMILES OC(C(C(=O)OCC)F)c1cc(ccc1)C
SPLASH splash10-006x-9600000000-dc238ff28961762eab49
Source of Spectrum J-67-3233-7
Wiley ID 1569816