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[4-(3,5-dibromo-2-hydroxy-p-tolyl)-1,3-dithiol-2-ylidene]dimethylammonium perchlorate
SpectraBase Compound ID qbh8ymg34x
InChI InChI=1S/C12H11Br2NOS2.ClHO4/c1-6-8(13)4-7(11(16)10(6)14)9-5-17-12(18-9)15(2)3;2-1(3,4)5/h4-5H,1-3H3;(H,2,3,4,5)
InChIKey XNXRPXIHSMGESU-UHFFFAOYSA-N
Mol Weight 509.61 g/mol
Molecular Formula C12H12Br2ClNO5S2
Exact Mass 506.821219 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ECd1e1JnRyO
Name [4-(3,5-dibromo-2-hydroxy-p-tolyl)-1,3-dithiol-2-ylidene]dimethylammonium perchlorate
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Formula C12H12Br2ClNO5S2
InChI InChI=1S/C12H11Br2NOS2.ClHO4/c1-6-8(13)4-7(11(16)10(6)14)9-5-17-12(18-9)15(2)3;2-1(3,4)5/h4-5H,1-3H3;(H,2,3,4,5)
InChIKey XNXRPXIHSMGESU-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 61339M
Solvent DMSO-d6