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4-(2-Amino-5-nitro-phenyl)-2-(4-nitro-phenyl)-4,5,6,7-tetrahydro-1,2,3-triaza-2H-indene

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4-(2-Amino-5-nitro-phenyl)-2-(4-nitro-phenyl)-4,5,6,7-tetrahydro-1,2,3-triaza-2H-indene
SpectraBase Compound ID 8E86MeH5DBJ
InChI InChI=1S/C18H16N6O4/c19-16-9-8-13(24(27)28)10-15(16)14-2-1-3-17-18(14)21-22(20-17)11-4-6-12(7-5-11)23(25)26/h4-10,14H,1-3,19H2
InChIKey IDGZKULSLCHQBO-UHFFFAOYSA-N
Mol Weight 380.36 g/mol
Molecular Formula C18H16N6O4
Exact Mass 380.123303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9oOI81Nq60K
Name 4-(2-Amino-5-nitro-phenyl)-2-(4-nitro-phenyl)-4,5,6,7-tetrahydro-1,2,3-triaza-2H-indene
CAS Registry Number 87837-71-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H16N6O4
InChI InChI=1S/C18H16N6O4/c19-16-9-8-13(24(27)28)10-15(16)14-2-1-3-17-18(14)21-22(20-17)11-4-6-12(7-5-11)23(25)26/h4-10,14H,1-3,19H2
InChIKey IDGZKULSLCHQBO-UHFFFAOYSA-N
Literature Reference R.N. Butler, J.P. James, J. Chem. Soc. Chem. Comm. 627 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6