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2,2'-(TETRAMETHYLENEDIOXY)-BIS-[4,6-BIS-(TRINITROMETHYL)]-1,3,5-TRIAZINE
SpectraBase Compound ID 4aUp3pTfM4e
InChI InChI=1S/C14H8N18O26/c33-21(34)11(22(35)36,23(37)38)5-15-6(12(24(39)40,25(41)42)26(43)44)18-9(17-5)57-3-1-2-4-58-10-19-7(13(27(45)46,28(47)48)29(49)50)16-8(20-10)14(30(51)52,31(53)54)32(55)56/h1-4H2
InChIKey AQVPFSNNFIVRQS-UHFFFAOYSA-N
Mol Weight 844.32 g/mol
Molecular Formula C14H8N18O26
Exact Mass 843.985712 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhCaSrrfwSD
Name 2,2'-(TETRAMETHYLENEDIOXY)-BIS-[4,6-BIS-(TRINITROMETHYL)]-1,3,5-TRIAZINE
Compound Number IX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H8N18O26
InChI InChI=1S/C14H8N18O26/c33-21(34)11(22(35)36,23(37)38)5-15-6(12(24(39)40,25(41)42)26(43)44)18-9(17-5)57-3-1-2-4-58-10-19-7(13(27(45)46,28(47)48)29(49)50)16-8(20-10)14(30(51)52,31(53)54)32(55)56/h1-4H2
InChIKey AQVPFSNNFIVRQS-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
Solvent CD2Cl2
Source File Reference UWMZ13544