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3-Formyl-6-methylthio-5-phenyl-thiopyrilium-perchlorate
SpectraBase Compound ID BTd6w7nzBn5
InChI InChI=1S/C13H11OS2.ClHO4/c1-15-13-12(7-10(8-14)9-16-13)11-5-3-2-4-6-11;2-1(3,4)5/h2-9H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey JZWCURXHYWNXST-UHFFFAOYSA-M
Mol Weight 346.8 g/mol
Molecular Formula C13H11ClO5S2
Exact Mass 345.973643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8PxhIRMhfOQ
Name 3-Formyl-6-methylthio-5-phenyl-thiopyrilium-perchlorate
Alternate Name(s) 5-formyl-2-(methylsulfanyl)-3-phenylthiopyrylium perchlorate
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Formula C13H11ClO5S2
InChI InChI=1S/C13H11OS2.ClHO4/c1-15-13-12(7-10(8-14)9-16-13)11-5-3-2-4-6-11;2-1(3,4)5/h2-9H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey JZWCURXHYWNXST-UHFFFAOYSA-M
Molecular Weight 346.799 g/mol
SMILES c1([s+]cc(cc1-c1ccccc1)C=O)SC.[Cl]([O-])(=O)(=O)=O
SPLASH splash10-00kr-6950000000-cb1ee2cbb1ecf231277f
Source of Spectrum AC-1976-1199-0
Wiley ID 1338895