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METERAZINE, DIMALEATE

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METERAZINE, DIMALEATE
SpectraBase Compound ID EvA5dr3zrz1
InChI InChI=1S/C20H24ClN3S.2C4H4O4/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24;2*5-3(6)1-2-4(7)8/h2-3,5-8,15H,4,9-14H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey DSKIOWHQLUWFLG-SPIKMXEPSA-N
Mol Weight 606.09 g/mol
Molecular Formula C28H32ClN3O8S
Exact Mass 605.159864 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3azog1WNMPT
Name METERAZINE, DIMALEATE
Comments /Ð
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Formula C28H32ClN3O8S
InChI InChI=1S/C20H24ClN3S.2C4H4O4/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24;2*5-3(6)1-2-4(7)8/h2-3,5-8,15H,4,9-14H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey DSKIOWHQLUWFLG-SPIKMXEPSA-N
Instrument Name Bruker WH-90
Literature Reference V.S.KARTASHOV, S.V.SHORSHNEV, A.P.ARZAMASTSEV (1991) Khim.Farm.Zhurn.(Russ.Lang.): v.25, N6, 85-88.
NMR Standard C4H8O2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo