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2-[1'-Oxo-3'-(trifluoromethyl)-3'-(methoxycarbonyl)-3'-hydroxypropyl]-pyridine
SpectraBase Compound ID BoVaplXsf3L
InChI InChI=1S/C11H10F3NO4/c1-19-9(17)10(18,11(12,13)14)5-8(16)7-3-2-4-15-6-7/h2-4,6,18H,5H2,1H3
InChIKey JSLUCMUDUJQUEM-UHFFFAOYSA-N
Mol Weight 277.2 g/mol
Molecular Formula C11H10F3NO4
Exact Mass 277.056192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBuyj7Joqmm
Name 2-[1'-Oxo-3'-(trifluoromethyl)-3'-(methoxycarbonyl)-3'-hydroxypropyl]-pyridine
Alternate Name(s) Methyl 2-hydroxy-4-oxo-4-(3-pyridinyl)-2-(trifluoromethyl)butanoate
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Formula C11H10F3NO4
InChI InChI=1S/C11H10F3NO4/c1-19-9(17)10(18,11(12,13)14)5-8(16)7-3-2-4-15-6-7/h2-4,6,18H,5H2,1H3
InChIKey JSLUCMUDUJQUEM-UHFFFAOYSA-N
Molecular Weight 277.199 g/mol
SMILES OC(C(F)(F)F)(CC(c1cnccc1)=O)C(=O)OC
SPLASH splash10-0a4i-5920000000-803c04634165f064afd2
Source of Spectrum HE-2005-1910-7
Wiley ID 1613778