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4-Chloro-2-(4-ethoxy-3-methoxyphenyl)-6-quinolinesulfonyl fluoride

View entire compound with spectra: 4 NMR, and 1 FTIR

4-Chloro-2-(4-ethoxy-3-methoxyphenyl)-6-quinolinesulfonyl fluoride
SpectraBase Compound ID 638tc3nVD8I
InChI InChI=1S/C18H15ClFNO4S/c1-3-25-17-7-4-11(8-18(17)24-2)16-10-14(19)13-9-12(26(20,22)23)5-6-15(13)21-16/h4-10H,3H2,1-2H3
InChIKey BMFXYVIGZFSTAY-UHFFFAOYSA-N
Mol Weight 395.83 g/mol
Molecular Formula C18H15ClFNO4S
Exact Mass 395.039435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5kxYdeZvPz4
Name 4-Chloro-2-(4-ethoxy-3-methoxyphenyl)-6-quinolinesulfonyl fluoride
Comments Computed using HOSE algorithm
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Formula C18H15ClFNO4S
InChI InChI=1S/C18H15ClFNO4S/c1-3-25-17-7-4-11(8-18(17)24-2)16-10-14(19)13-9-12(26(20,22)23)5-6-15(13)21-16/h4-10H,3H2,1-2H3
InChIKey BMFXYVIGZFSTAY-UHFFFAOYSA-N
Molecular Weight 395.832 g/mol
SMILES C=12C=C(C=CC1N=C(C=C2Cl)C=1C=CC(=C(C1)OC)OCC)S(=O)(=O)F