CAS 35869-41-1

3,3-Dimethyl-1-nitrobutan-2-one

CAS: 35869-41-1

3,3-Dimethyl-1-nitrobutan-2-one is a ligand that is used in magnetic resonance spectroscopy. It has an axial symmetry and a square planar geometry with four apical nitrogens and four tetragonally equatorial nitrogens. The oxygen atoms are located equatorially. The ligand has two magnetic isotopes, one of which is 3,3-dimethyl-1-nitrobutan-2-one (DMB) with a nuclear spin of 1/2 and the other being 2,2'-dimethylpropionyloxybutyronitrile (DMPRB) with a nuclear spin of 3/2. The electronic spectrum for DMB spans from about 0.4 to about 10 MHz, while the spectrum for DMPRB spans from about 0.4 to about 5 MHz. 3,3-Dimethyl-1-nitrobutan-2-one also has a chrom

Formula: C₆H₁₁NO₃

Purity: Min. 95%

Molecular weight: 145.16 g/mol

Ref: 3D-KBA86941