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(+-)-4'-METHYL-N-ETHYLCATHINONE-HYDROBROMIDE;4-MEC
SpectraBase Compound ID EDlUR70uuys
InChI InChI=1S/C12H17NO.BrH/c1-4-13-10(3)12(14)11-7-5-9(2)6-8-11;/h5-8,10,13H,4H2,1-3H3;1H
InChIKey KAFVRCSKOASSEU-UHFFFAOYSA-N
Mol Weight 272.19 g/mol
Molecular Formula C12H18BrNO
Exact Mass 271.057177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6YPFIauq71j
Name (+-)-4'-METHYL-N-ETHYLCATHINONE-HYDROBROMIDE;4-MEC
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18BrNO
InChI InChI=1S/C12H17NO.BrH/c1-4-13-10(3)12(14)11-7-5-9(2)6-8-11;/h5-8,10,13H,4H2,1-3H3;1H
InChIKey KAFVRCSKOASSEU-UHFFFAOYSA-N
Literature Reference Author O.I.G.KHREIT,C.IRVING,E.SCHMIDT,J.A.PARKINSON,N.N.DAEID,O.B. SUTCLIFFE
Literature Reference Citation J.PHARM.BIOM.ANAL.,61,122(2012)
Literature Reference DOI 10.1016/j.jpba.2011.11.004
Molecular Weight 272.185 g/mol
Solvent DMSO-D6
Source File Reference UWMZ44031