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5-(TRINITROMETHYL)-TETRAZOL_TETRABUTYLAMMONIUM_SALT
SpectraBase Compound ID 7BjmnqueDAL
InChI InChI=1S/C16H36N.C2N7O6/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;10-7(11)2(8(12)13,9(14)15)1-3-5-6-4-1/h5-16H2,1-4H3;/q+1;-1
InChIKey HHIVSLYMBUAOBA-UHFFFAOYSA-N
Mol Weight 460.54 g/mol
Molecular Formula C18H36N8O6
Exact Mass 460.275781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5wNdrdXReIL
Name 5-(TRINITROMETHYL)-TETRAZOL_TETRABUTYLAMMONIUM_SALT
Compound Number III
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H36N8O6
InChI InChI=1S/C16H36N.C2N7O6/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;10-7(11)2(8(12)13,9(14)15)1-3-5-6-4-1/h5-16H2,1-4H3;/q+1;-1
InChIKey HHIVSLYMBUAOBA-UHFFFAOYSA-N
Literature Reference Author A.V.SHASTIN,T.I.GODOVIKOVA,B.L.KORSUNSKII
Literature Reference Citation CHEM.HET.COMP.,34,383(1998)
Literature Reference DOI 10.1007/bf02290739
Molecular Weight 460.534 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ14506