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Acranil dication

View entire compound with spectra: 1 NMR

Acranil dication
SpectraBase Compound ID AOLsZ8zbag3
InChI InChI=1S/C21H26ClN3O2/c1-4-25(5-2)13-15(26)12-23-21-17-8-6-14(22)10-20(17)24-19-9-7-16(27-3)11-18(19)21/h6-11,15,26H,4-5,12-13H2,1-3H3,(H,23,24)/p+2
InChIKey UDDPPYHULIXFDV-UHFFFAOYSA-P
Mol Weight 389.93 g/mol
Molecular Formula C21H28ClN3O2
Exact Mass 389.187005 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EVNocBRjmra
Name Acranil dication
Comments hydrochloride
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H28ClN3O2
InChI InChI=1S/C21H26ClN3O2/c1-4-25(5-2)13-15(26)12-23-21-17-8-6-14(22)10-20(17)24-19-9-7-16(27-3)11-18(19)21/h6-11,15,26H,4-5,12-13H2,1-3H3,(H,23,24)/p+2
InChIKey UDDPPYHULIXFDV-UHFFFAOYSA-P
Instrument Name Jeol FX-60
Literature Reference B.G. Griggs, D. Wilson, D.W. Boykin, Org. Magn. Resonance 11, 81 (1978).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O