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1-(2,4,6-trinitrophenethyl)pyridin-1-ium 4-methylbenzenesulfonate
SpectraBase Compound ID Ay7gOzSmGut
InChI InChI=1S/C13H11N4O6.C7H8O3S/c18-15(19)10-8-12(16(20)21)11(13(9-10)17(22)23)4-7-14-5-2-1-3-6-14;1-6-2-4-7(5-3-6)11(8,9)10/h1-3,5-6,8-9H,4,7H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey KCQIDXKXVPZQFC-UHFFFAOYSA-M
Mol Weight 490.44 g/mol
Molecular Formula C20H18N4O9S
Exact Mass 490.079449 g/mol
Parent InChIKey BTPNJVJWQKVORI-UHFFFAOYSA-M
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Solvent DMSO-d6

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