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2-[[3-keto-3-(2-keto-4,6-dimethyl-1H-pyridin-3-yl)-1-(trifluoromethyl)propyl]thio]acetic acid ethyl ester
SpectraBase Compound ID EvTbyr2wg5J
InChI InChI=1S/C15H18F3NO4S/c1-4-23-12(21)7-24-11(15(16,17)18)6-10(20)13-8(2)5-9(3)19-14(13)22/h5,11H,4,6-7H2,1-3H3,(H,19,22)
InChIKey ZJROXQHBCAYGDN-UHFFFAOYSA-N
Mol Weight 365.37 g/mol
Molecular Formula C15H18F3NO4S
Exact Mass 365.090864 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lytLNoQwqr
Name 2-[[3-keto-3-(2-keto-4,6-dimethyl-1H-pyridin-3-yl)-1-(trifluoromethyl)propyl]thio]acetic acid ethyl ester
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Formula C15H18F3NO4S
InChI InChI=1S/C15H18F3NO4S/c1-4-23-12(21)7-24-11(15(16,17)18)6-10(20)13-8(2)5-9(3)19-14(13)22/h5,11H,4,6-7H2,1-3H3,(H,19,22)
InChIKey ZJROXQHBCAYGDN-UHFFFAOYSA-N
Molecular Weight 365.367 g/mol
SMILES N1C(C(=C(C=C1C)C)C(=O)CC(SCC(OCC)=O)C(F)(F)F)=O
SPLASH splash10-0udm-8930000000-b0f936ee605e507eadec
Synonyms 2-[[4-(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]thio]acetic acid ethyl ester Ethyl 2-[3-(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)-3-oxo-1-(trifluoromethyl)propyl]sulfanylacetate Ethyl 2-[4-(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)-1,1,1-tris(fluoranyl)-4-oxidanylidene-butan-2-yl]sulfanylethanoate Ethyl 2-[4-(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanylacetate [3-(4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-3-oxo-1-trifluoromethylpropylsulfanyl]acetic acid, ethyl ester
Wiley ID 1447806