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Methyl 2-((2-chloro-6-(methylsulfonamido)-7-phenoxyquinolin-3-yl)(hydroxy)methyl)acrylate
SpectraBase Compound ID 8ztrc6iLRpa
InChI InChI=1S/C21H19ClN2O6S/c1-12(21(26)29-2)19(25)15-9-13-10-17(24-31(3,27)28)18(11-16(13)23-20(15)22)30-14-7-5-4-6-8-14/h4-11,19,24-25H,1H2,2-3H3
InChIKey DRKWLVWLBJPGAN-UHFFFAOYSA-N
Mol Weight 462.9 g/mol
Molecular Formula C21H19ClN2O6S
Exact Mass 462.065235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJge0eg6C9T
Name Methyl 2-((2-chloro-6-(methylsulfonamido)-7-phenoxyquinolin-3-yl)(hydroxy)methyl)acrylate
Alternate Name(s) 2-[[2-chloro-6-(methanesulfonamido)-7-phenoxy-3-quinolinyl]-hydroxymethyl]-2-propenoic acid methyl ester methyl 2-[[2-chloro-6-(methanesulfonamido)-7-phenoxyquinolin-3-yl]-hydroxymethyl]prop-2-enoate methyl 2-[[2-chloro-6-(methanesulfonamido)-7-phenoxy-3-quinolyl]-hydroxy-methyl]prop-2-enoate methyl 2-[[2-chloranyl-6-(methylsulfonylamino)-7-phenoxy-quinolin-3-yl]-oxidanyl-methyl]prop-2-enoate
Comments Less than 3 mono-isotopic peaks
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Formula C21H19ClN2O6S
InChI InChI=1S/C21H19ClN2O6S/c1-12(21(26)29-2)19(25)15-9-13-10-17(24-31(3,27)28)18(11-16(13)23-20(15)22)30-14-7-5-4-6-8-14/h4-11,19,24-25H,1H2,2-3H3
InChIKey DRKWLVWLBJPGAN-UHFFFAOYSA-N
Molecular Weight 462.904 g/mol
SMILES N(S(=O)(=O)C)c1cc2c(nc(c(C(C(C(=O)OC)=C)O)c2)Cl)cc1Oc1ccccc1
SPLASH splash10-03di-0000900000-e8065c6a9364d1f88bd5
Source of Spectrum Y-49-86-3g
Wiley ID 1706637