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10-(2-chloroacetyl)-2,2-dimethyl-3H-[1,3,5]triazino[1,6-a]benzimidazol-4-one

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10-(2-chloroacetyl)-2,2-dimethyl-3H-[1,3,5]triazino[1,6-a]benzimidazol-4-one
SpectraBase Compound ID DumIYuFH2gF
InChI InChI=1S/C13H13ClN4O2/c1-13(2)15-11-17(10(19)7-14)8-5-3-4-6-9(8)18(11)12(20)16-13/h3-6H,7H2,1-2H3,(H,16,20)
InChIKey NZTOUTIAIZDXBK-UHFFFAOYSA-N
Mol Weight 292.73 g/mol
Molecular Formula C13H13ClN4O2
Exact Mass 292.072703 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DiI1PdGN1vn
Name 10-Chloroacetyl-4-hydroxy-2,2-dimethyl-2,5-dihydro-1,3,5-triazino(1,2-A)benzimidazoline
CAS Registry Number 89992-32-5
Comments 25% IMPURITY PRESENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13ClN4O2
InChI InChI=1S/C13H13ClN4O2/c1-13(2)15-11-17(10(19)7-14)8-5-3-4-6-9(8)18(11)12(20)16-13/h3-6H,7H2,1-2H3,(H,16,20)
InChIKey NZTOUTIAIZDXBK-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