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(4-methyl-2-sulfanylidene-chromen-7-yl) benzenesulfonate
SpectraBase Compound ID D4bTOKX3E2Q
InChI InChI=1S/C16H12O4S2/c1-11-9-16(21)19-15-10-12(7-8-14(11)15)20-22(17,18)13-5-3-2-4-6-13/h2-10H,1H3
InChIKey IXYVZDLTJACCMM-UHFFFAOYSA-N
Mol Weight 332.39 g/mol
Molecular Formula C16H12O4S2
Exact Mass 332.017701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 448HVuQDRrP
Name (4-methyl-2-sulfanylidene-chromen-7-yl) benzenesulfonate
Alternate Name(s) (4-methyl-2-thioxo-chromen-7-yl) benzenesulfonate benzenesulfonic acid (4-methyl-2-sulfanylidene-1-benzopyran-7-yl) ester benzenesulfonic acid (4-methyl-2-thioxo-chromen-7-yl) ester
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Formula C16H12O4S2
InChI InChI=1S/C16H12O4S2/c1-11-9-16(21)19-15-10-12(7-8-14(11)15)20-22(17,18)13-5-3-2-4-6-13/h2-10H,1H3
InChIKey IXYVZDLTJACCMM-UHFFFAOYSA-N
Molecular Weight 332.388 g/mol
SMILES c1(OS(=O)(=O)c2ccccc2)cc2OC(=S)C=C(c2cc1)C
SPLASH splash10-005c-9400000000-c28ded3bd82e3b3186e2
Source of Spectrum AJ-42-742-24
Wiley ID 1567962