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3-Isoxazolecarboxylic acid, 5-(4-fluorophenyl)-, methyl ester
SpectraBase Compound ID 7JuDREvL9kM
InChI InChI=1S/C11H8FNO3/c1-15-11(14)9-6-10(16-13-9)7-2-4-8(12)5-3-7/h2-6H,1H3
InChIKey NBLMSLSUZWYTFT-UHFFFAOYSA-N
Mol Weight 221.19 g/mol
Molecular Formula C11H8FNO3
Exact Mass 221.048821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCohCbOD7GU
Name 3-Isoxazolecarboxylic acid, 5-(4-fluorophenyl)-, methyl ester
Alternate Name(s) 5-(4-fluorophenyl)-3-isoxazolecarboxylic acid methyl ester Methyl 5-(4-fluorophenyl)isoxazole-3-carboxylate Methyl 5-(4-fluorophenyl)-1,2-oxazole-3-carboxylate
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Formula C11H8FNO3
InChI InChI=1S/C11H8FNO3/c1-15-11(14)9-6-10(16-13-9)7-2-4-8(12)5-3-7/h2-6H,1H3
InChIKey NBLMSLSUZWYTFT-UHFFFAOYSA-N
Molecular Weight 221.187 g/mol
SMILES c1cc(ccc1-c1cc(C(=O)OC)no1)F
SPLASH splash10-0ab9-9400000000-40187f76267bf88ce5f9
Source of Spectrum IY-1-4311-9
Wiley ID 1651102