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2H-Thiopyrano[3,2-b][1]benzothiophen-2-one, 4-phenyl-, 5,5-dioxide
SpectraBase Compound ID 9e1WJEzvzEK
InChI InChI=1S/C17H10O3S2/c18-15-10-13(11-6-2-1-3-7-11)17-16(21-15)12-8-4-5-9-14(12)22(17,19)20/h1-10H
InChIKey WUDAAIIWOHECLG-UHFFFAOYSA-N
Mol Weight 326.38 g/mol
Molecular Formula C17H10O3S2
Exact Mass 326.007137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDDeR3024PD
Name 2H-Thiopyrano[3,2-b][1]benzothiophen-2-one, 4-phenyl-, 5,5-dioxide
Alternate Name(s) 2-Phenyl-2H-thiopyrano[3,2-b][1]benzothiophen-2-one 4-phenyl-2H-thiino[3,2-b][1]benzothiophen-2-one 5,5-dioxide 4-Phenyl-2H-[1]-benzothieno[3,2-b]pyran-2-thione 5,5-dioxide
CAS Registry Number 87894-71-1
Comments Less than 3 mono-isotopic peaks
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Formula C17H10O3S2
InChI InChI=1S/C17H10O3S2/c18-15-10-13(11-6-2-1-3-7-11)17-16(21-15)12-8-4-5-9-14(12)22(17,19)20/h1-10H
InChIKey WUDAAIIWOHECLG-UHFFFAOYSA-N
Molecular Weight 326.384 g/mol
SMILES C1=2S(c3c(C2SC(C=C1c1ccccc1)=O)cccc3)(=O)=O
SPLASH splash10-0002-0092000000-bbe8472ef77d9c968e7f
Source of Spectrum KC-1983-1429-0
Wiley ID 1324617