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[4-(3,5-dichloro-2-hydroxyphenyl)-1,3-dithiol-2-ylidene]dimethylammonium hydrogen sulfate
SpectraBase Compound ID DSs6cFd8B7t
InChI InChI=1S/C11H9Cl2NOS2.H2O4S/c1-14(2)11-16-5-9(17-11)7-3-6(12)4-8(13)10(7)15;1-5(2,3)4/h3-5H,1-2H3;(H2,1,2,3,4)
InChIKey AGGFNGLDSWEUNE-UHFFFAOYSA-N
Mol Weight 404.3 g/mol
Molecular Formula C11H11Cl2NO5S3
Exact Mass 402.917641 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9n1XCIUCme
Name [4-(3,5-dichloro-2-hydroxyphenyl)-1,3-dithiol-2-ylidene]dimethylammonium hydrogen sulfate
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Formula C11H11Cl2NO5S3
InChI InChI=1S/C11H9Cl2NOS2.H2O4S/c1-14(2)11-16-5-9(17-11)7-3-6(12)4-8(13)10(7)15;1-5(2,3)4/h3-5H,1-2H3;(H2,1,2,3,4)
InChIKey AGGFNGLDSWEUNE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 47311M
Solvent DMSO-d6