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thyl 4-(2,2,2-trifluoroethoxy)quinoline-3-carboxylate
SpectraBase Compound ID 9KB9iKjYm57
InChI InChI=1S/C14H12F3NO3/c1-2-20-13(19)10-7-18-11-6-4-3-5-9(11)12(10)21-8-14(15,16)17/h3-7H,2,8H2,1H3
InChIKey ZCMLQTCUHYVJDC-UHFFFAOYSA-N
Mol Weight 299.25 g/mol
Molecular Formula C14H12F3NO3
Exact Mass 299.076928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKHt1T6YmpO
Name thyl 4-(2,2,2-trifluoroethoxy)quinoline-3-carboxylate
Appearance Pale yellow solid
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Exact Mass 299.076927736 u
Formula C14H12F3NO3
InChI InChI=1S/C14H12F3NO3/c1-2-20-13(19)10-7-18-11-6-4-3-5-9(11)12(10)21-8-14(15,16)17/h3-7H,2,8H2,1H3
InChIKey ZCMLQTCUHYVJDC-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201704205
Molecular Weight 299.249 g/mol
Quality 348
Reported Formula C14H12F3NO3
SMILES C1=CC2=C(C=C1)N=CC(=C2OCC(F)(F)F)C(=O)OCC
SPLASH splash10-0ue9-1980000000-0d0dfbab85ced6af147d
Source of Spectrum QE-23-SM17-4e (DOI: 10.1002/chem.201704205)
Thin-Layer Chromatography 0.28 (hex/EtOAc, 4:1)
Wiley ID 1905993