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Benzenesulfonic acid, 4-methyl-, (6-chloro-4-methyl-2-oxo-2H-chromen-7-yl) ester
SpectraBase Compound ID FHkCT7yfv4P
InChI InChI=1S/C17H13ClO5S/c1-10-3-5-12(6-4-10)24(20,21)23-16-9-15-13(8-14(16)18)11(2)7-17(19)22-15/h3-9H,1-2H3
InChIKey UCTUFKSJDTXSMS-UHFFFAOYSA-N
Mol Weight 364.8 g/mol
Molecular Formula C17H13ClO5S
Exact Mass 364.017222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDXTvHiCaN9
Name Benzenesulfonic acid, 4-methyl-, (6-chloro-4-methyl-2-oxo-2H-chromen-7-yl) ester
Alternate Name(s) (6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 4-methylbenzenesulfonate (6-chloro-4-methyl-2-oxo-chromen-7-yl) 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid (6-chloro-2-keto-4-methyl-chromen-7-yl) ester 4-Methylbenzenesulfonic acid (6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester 6-Chloro-4-methyl-2-oxo-2H-chromen-7-yl 4-methylbenzenesulfonate
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Formula C17H13ClO5S
InChI InChI=1S/C17H13ClO5S/c1-10-3-5-12(6-4-10)24(20,21)23-16-9-15-13(8-14(16)18)11(2)7-17(19)22-15/h3-9H,1-2H3
InChIKey UCTUFKSJDTXSMS-UHFFFAOYSA-N
Molecular Weight 364.799 g/mol
SMILES Cc1ccc(S(Oc2cc3OC(=O)C=C(c3cc2Cl)C)(=O)=O)cc1
SPLASH splash10-052f-9402000000-d1007e62dc50af28fa53
Source of Spectrum AD-0-2532-0
Wiley ID 1428930