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2,4,6-TRINITRO-4'-CYANODIPHENYLAMINE

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2,4,6-TRINITRO-4'-CYANODIPHENYLAMINE
SpectraBase Compound ID CMuSC4BLdXn
InChI InChI=1S/C13H7N5O6/c14-7-8-1-3-9(4-2-8)15-13-11(17(21)22)5-10(16(19)20)6-12(13)18(23)24/h1-6,15H
InChIKey QPYFUWUSTUFKJO-UHFFFAOYSA-N
Mol Weight 329.23 g/mol
Molecular Formula C13H7N5O6
Exact Mass 329.039633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C28WiffsWKL
Name 2,4,6-TRINITRO-4'-CYANODIPHENYLAMINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H7N5O6
InChI InChI=1S/C13H7N5O6/c14-7-8-1-3-9(4-2-8)15-13-11(17(21)22)5-10(16(19)20)6-12(13)18(23)24/h1-6,15H
InChIKey QPYFUWUSTUFKJO-UHFFFAOYSA-N
Literature Reference Author A.LYCKA,V.MACHACEK,J.JIRMAN
Literature Reference Citation COLL.CZ.CH.COMM.,52,2946(1987)
Literature Reference DOI 10.1135/cccc19872946
Molecular Weight 329.228 g/mol
Solvent DMSO-D6
Source File Reference UWCS4873