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4-chloro-2-[p-(fluorosulfonyl)phenyl]-6-quinolinecarboxylic acid, ethyl ester
SpectraBase Compound ID 39eRl2ajsBz
InChI InChI=1S/C18H13ClFNO4S/c1-2-25-18(22)12-5-8-16-14(9-12)15(19)10-17(21-16)11-3-6-13(7-4-11)26(20,23)24/h3-10H,2H2,1H3
InChIKey IAEGOMJZXABRBV-UHFFFAOYSA-N
Mol Weight 393.82 g/mol
Molecular Formula C18H13ClFNO4S
Exact Mass 393.023785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCx2wQQ7TPq
Name 6-Quinolinecarboxylic acid, 4-chloro-2-[4-(fluorosulfonyl)phenyl]-, ethyl ester
Alternate Name(s) Ethyl 4-chloro-2-[4-(fluorosulfonyl)phenyl]-6-quinolinecarboxylate 4-Chloro-2-(4-fluorosulfonylphenyl)-6-quinolinecarboxylic acid ethyl ester 4-Chloro-2-(4-fluorosulfonylphenyl)quinoline-6-carboxylic acid ethyl ester Ethyl 4-chloranyl-2-(4-fluorosulfonylphenyl)quinoline-6-carboxylate Ethyl 4-chloro-2-(4-(fluorosulphonyl)phenyl)quinoline-6-carboxylate Ethyl 4-chloro-2-(4-fluorosulfonylphenyl)quinoline-6-carboxylate Ethyl 4-chloro-2-(para-fluorosulfonylphenyl)-6-quinolinecarboxylate EINECS 264-878-9
CAS Registry Number 64415-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClFNO4S
InChI InChI=1S/C18H13ClFNO4S/c1-2-25-18(22)12-5-8-16-14(9-12)15(19)10-17(21-16)11-3-6-13(7-4-11)26(20,23)24/h3-10H,2H2,1H3
InChIKey IAEGOMJZXABRBV-UHFFFAOYSA-N
Molecular Weight 393.816 g/mol
SMILES c1(Cl)c2c(nc(c1)-c1ccc(S(F)(=O)=O)cc1)ccc(c2)C(OCC)=O
SPLASH splash10-0002-5339200000-ccdde840e1666aab1975
Source of Spectrum W5-33248-32288-32288
Wiley ID 1366183