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1-METHYL-3,6,8-TRINITRO-2-QUINOLONE;TNQ-ME
SpectraBase Compound ID JmsOloujZKn
InChI InChI=1S/C10H6N4O7/c1-11-9-5(3-8(10(11)15)14(20)21)2-6(12(16)17)4-7(9)13(18)19/h2-4H,1H3
InChIKey GXVCAPUIZBOAHQ-UHFFFAOYSA-N
Mol Weight 294.18 g/mol
Molecular Formula C10H6N4O7
Exact Mass 294.023649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2zi1RKHWfXC
Name 1-METHYL-3,6,8-TRINITRO-2-QUINOLONE;TNQ-ME
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H6N4O7
InChI InChI=1S/C10H6N4O7/c1-11-9-5(3-8(10(11)15)14(20)21)2-6(12(16)17)4-7(9)13(18)19/h2-4H,1H3
InChIKey GXVCAPUIZBOAHQ-UHFFFAOYSA-N
Literature Reference Author N.NISHIWAKI,C.TANAKA,M.ASAHARA,N.ASAKA,Y.TOHDA,M.ARIGA
Literature Reference Citation HETEROCYCLES,51,567(1999)
Literature Reference DOI 10.3987/COM-98-8416
Molecular Weight 294.180 g/mol
Solvent DMSO-D6
Source File Reference UWVP7401