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1,2,4-Triazine-6-carbonitrile, 2-(2,4-dinitrophenyl)-2,3,4,5-tetrahydro-5-imino-4-methyl-3-oxo-
SpectraBase Compound ID 8X8L1L4pHHq
InChI InChI=1S/C11H7N7O5/c1-15-10(13)7(5-12)14-16(11(15)19)8-3-2-6(17(20)21)4-9(8)18(22)23/h2-4,13H,1H3
InChIKey CCBWGCIHDRYUFE-UHFFFAOYSA-N
Mol Weight 317.22 g/mol
Molecular Formula C11H7N7O5
Exact Mass 317.050866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7pxw7tS9Yf
Name 1,2,4-Triazine-6-carbonitrile, 2-(2,4-dinitrophenyl)-2,3,4,5-tetrahydro-5-imino-4-methyl-3-oxo-
Alternate Name(s) 2-(2,4-Dinitrophenyl)-3-oxo-4-methyl-5-imino-6-cyano-2,3,4,5-tetrahydro-1,2,4-triazine 2-(2,4-dinitrophenyl)-5-imino-4-methyl-3-oxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
CAS Registry Number 66706-88-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7N7O5
InChI InChI=1S/C11H7N7O5/c1-15-10(13)7(5-12)14-16(11(15)19)8-3-2-6(17(20)21)4-9(8)18(22)23/h2-4,13H,1H3
InChIKey CCBWGCIHDRYUFE-UHFFFAOYSA-N
Molecular Weight 317.221 g/mol
SMILES N=C1C(=NN(C(N1C)=O)c1c(N(=O)=O)cc(N(=O)=O)cc1)C#N
SPLASH splash10-00dj-0491000000-c84c16851665df95642f
Source of Spectrum H-61-1177-0
Wiley ID 1317470