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(E)-1-N'-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine
SpectraBase Compound ID K7smmFENDvH
InChI InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
InChIKey VMXUWOKSQNHOCA-UKTHLTGXSA-N
Mol Weight 314.4 g/mol
Molecular Formula C13H22N4O3S
Exact Mass 314.141262 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 44CO7yw3yeu
Name N-([2-(5-Dimethylaminomethyl-2-furanyl)-methylthio]-ethyl)-N'-methyl-2-nitro-1,1-ethenediamine
CAS Registry Number 66357-35-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H22N4O3S
InChI InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
InChIKey VMXUWOKSQNHOCA-UKTHLTGXSA-N
Instrument Name Varian XL-200
Literature Reference E. Gaggelli, N. Marchettini, G. Valensin, Magn. Res. Chem. 26, 1041 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6