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(2,2',4,4',6,6'-Hexanitro-diphenyl)-methyl anion
SpectraBase Compound ID JMHS0cQnwvg
InChI InChI=1S/C13H5N6O12/c20-14(21)6-1-10(16(24)25)8(11(2-6)17(26)27)5-9-12(18(28)29)3-7(15(22)23)4-13(9)19(30)31/h1-5H/q-1
InChIKey BKRIYJSCDFKSGB-UHFFFAOYSA-N
Mol Weight 437.21 g/mol
Molecular Formula C13H5N6O12
Exact Mass 436.996545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BKzlTrnohia
Name (2,2',4,4',6,6'-Hexanitro-diphenyl)-methyl anion
CAS Registry Number 126083-71-4
Comments BRUKER AM 250 SPECTROMETER, POTASSIUM SALT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H5N6O12
InChI InChI=1S/C13H5N6O12/c20-14(21)6-1-10(16(24)25)8(11(2-6)17(26)27)5-9-12(18(28)29)3-7(15(22)23)4-13(9)19(30)31/h1-5H/q-1
InChIKey BKRIYJSCDFKSGB-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference M-P. Simonnin, H-Q. Xie, F. Terrier, J. Chem. Soc. Perkin II 1553 (1989).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6