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2-(2,4-Dinitrophenyl)-8-methyl-1-oxo-2,4,5,6-tetrahydro-2,3,7-triazaphenalene
SpectraBase Compound ID L2EAgdQzPcj
InChI InChI=1S/C17H13N5O5/c1-9-7-11-16-12(18-9)3-2-4-13(16)19-20(17(11)23)14-6-5-10(21(24)25)8-15(14)22(26)27/h5-8H,2-4H2,1H3
InChIKey HNUMXCYCNPGEPI-UHFFFAOYSA-N
Mol Weight 367.32 g/mol
Molecular Formula C17H13N5O5
Exact Mass 367.091669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KDkyLV5Ync
Name 2-(2,4-Dinitrophenyl)-8-methyl-1-oxo-2,4,5,6-tetrahydro-2,3,7-triazaphenalene
Alternate Name(s) 2-(2,4-dinitrophenyl)-5-methyl-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]cinnolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13N5O5
InChI InChI=1S/C17H13N5O5/c1-9-7-11-16-12(18-9)3-2-4-13(16)19-20(17(11)23)14-6-5-10(21(24)25)8-15(14)22(26)27/h5-8H,2-4H2,1H3
InChIKey HNUMXCYCNPGEPI-UHFFFAOYSA-N
Molecular Weight 367.321 g/mol
SMILES C12=NN(C(c3c1c(CCC2)nc(c3)C)=O)c1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-00kr-0932000000-20834a4a1b04bc8b0b27
Source of Spectrum H1-41-36-1
Wiley ID 757099