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ammonium 2,4,6-trinitro-N-(2,4,6-trinitro-2,5-cyclohexadien-1-ylidene)aniline

View entire compound with spectra: 1 NMR, and 1 FTIR

ammonium 2,4,6-trinitro-N-(2,4,6-trinitro-2,5-cyclohexadien-1-ylidene)aniline
SpectraBase Compound ID FVEw1CIGYAr
InChI InChI=1S/C12H4N7O12.H3N/c20-14(21)5-1-7(16(24)25)11(8(2-5)17(26)27)13-12-9(18(28)29)3-6(15(22)23)4-10(12)19(30)31;/h1-4H;1H3/q-1;/p+1
InChIKey KNACDGDHMSVPPU-UHFFFAOYSA-O
Mol Weight 456.24 g/mol
Molecular Formula C12H8N8O12
Exact Mass 456.026168 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JXuvENjnfWW
Name AMMONIUM 2,4,6-TRINITRO-N-(2,4,6-TRINITRO-2,5-CYCLOHEXADIEN-1-YLIDENE)ANILINE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8N8O12
InChI InChI=1S/C12H4N7O12.H3N/c20-14(21)5-1-7(16(24)25)11(8(2-5)17(26)27)13-12-9(18(28)29)3-6(15(22)23)4-10(12)19(30)31;/h1-4H;1H3/q-1;/p+1
InChIKey KNACDGDHMSVPPU-UHFFFAOYSA-O
Molecular Weight 456.24
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20