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3-methyl-10H-[1,3,5]triazino[6,1-b]benzimidazole-2,4-quinone
SpectraBase Compound ID EWhBfeCXYdg
InChI InChI=1S/C10H8N4O2/c1-13-9(15)12-8-11-6-4-2-3-5-7(6)14(8)10(13)16/h2-5H,1H3,(H,11,12,15)
InChIKey RRILSYUCONZCEA-UHFFFAOYSA-N
Mol Weight 216.2 g/mol
Molecular Formula C10H8N4O2
Exact Mass 216.064726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3WL5y30TnYr
Name 3-Methyl-2,4(3H,5H)-dioxo-1,3,5-triazino(3,2-A)benzimidazoline
CAS Registry Number 41195-76-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H8N4O2
InChI InChI=1S/C10H8N4O2/c1-13-9(15)12-8-11-6-4-2-3-5-7(6)14(8)10(13)16/h2-5H,1H3,(H,11,12,15)
InChIKey RRILSYUCONZCEA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference E. Gruendemann, H. Graubaum, D. Martin, Magn. Res. Chem. 24, 21 (1986).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6