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2-(METHYLPHENYLAMINO)-4,6-BIS-(TRINITROMETHYL)-1,3,5-TRIAZINE
SpectraBase Compound ID EjkQZxoZvzB
InChI InChI=1S/C12H8N10O12/c1-16(7-5-3-2-4-6-7)10-14-8(11(17(23)24,18(25)26)19(27)28)13-9(15-10)12(20(29)30,21(31)32)22(33)34/h2-6H,1H3
InChIKey GSAXMQRQDANNSQ-UHFFFAOYSA-N
Mol Weight 484.25 g/mol
Molecular Formula C12H8N10O12
Exact Mass 484.032316 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9fdjkwB8YZT
Name 2-(METHYLPHENYLAMINO)-4,6-BIS-(TRINITROMETHYL)-1,3,5-TRIAZINE
Compound Number XIII
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Formula C12H8N10O12
InChI InChI=1S/C12H8N10O12/c1-16(7-5-3-2-4-6-7)10-14-8(11(17(23)24,18(25)26)19(27)28)13-9(15-10)12(20(29)30,21(31)32)22(33)34/h2-6H,1H3
InChIKey GSAXMQRQDANNSQ-UHFFFAOYSA-N
Literature Reference Author A.V.SHASTIN,T.I.GODOVIKOVA,S.P.GOLOVA,L.I.KHMELNITSKII,B.L.K ORSUNSKII
Literature Reference Citation CHEM.HET.COMP.,31,596(1995)
Literature Reference DOI 10.1007/bf01166337
Molecular Weight 484.255 g/mol
Solvent CDCl3
Source File Reference UWMZ13539