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N-methyl-N,2,4,6-tetranitroaniline
SpectraBase Compound ID D99eqf6tpGb
InChI InChI=1S/C7H5N5O8/c1-8(12(19)20)7-5(10(15)16)2-4(9(13)14)3-6(7)11(17)18/h2-3H,1H3
InChIKey AGUIVNYEYSCPNI-UHFFFAOYSA-N
Mol Weight 287.14 g/mol
Molecular Formula C7H5N5O8
Exact Mass 287.013812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3DyMfxI6lwX
Name N-Methyl-N-(2,4,6-trinitrophenyl)-nitramine
CAS Registry Number 479-45-8
Comments N-15 ENRICHED AT EACH N
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H5N5O8
InChI InChI=1S/C7H5N5O8/c1-8(12(19)20)7-5(10(15)16)2-4(9(13)14)3-6(7)11(17)18/h2-3H,1H3
InChIKey AGUIVNYEYSCPNI-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference S. Bulusu, T. Axenrod, J.R. Autera, Org. Magn. Resonance 16, 52 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6