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HEMIPROPANOYLCARNITINIUM-(HPRC);(2S,6R)-6-(CARBOXYMETHYL)-2-ETHYL-2-HYDROXY-4,4-DIMETHYLMORPHOLINUM-BROMIDE
SpectraBase Compound ID 2goDl4MaP0W
InChI InChI=1S/C10H19NO4.BrH/c1-4-10(14)7-11(2,3)6-8(15-10)5-9(12)13;/h8,14H,4-7H2,1-3H3;1H/t8-,10+;/m1./s1
InChIKey MSFVGIGUSRRABB-SCYNACPDSA-N
Mol Weight 298.18 g/mol
Molecular Formula C10H20BrNO4
Exact Mass 297.057571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AVPnm1PIf8a
Name HEMIPROPANOYLCARNITINIUM-(HPRC);(2S,6R)-6-(CARBOXYMETHYL)-2-ETHYL-2-HYDROXY-4,4-DIMETHYLMORPHOLINUM-BROMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H20BrNO4
InChI InChI=1S/C10H19NO4.BrH/c1-4-10(14)7-11(2,3)6-8(15-10)5-9(12)13;/h8,14H,4-7H2,1-3H3;1H/t8-,10+;/m1./s1
InChIKey MSFVGIGUSRRABB-SCYNACPDSA-N
Literature Reference Author R.D.GANDOUR,N.L.BLACKWELL,W.J.COLUCCI,C.CHUNG,L.L.BIEBER,R.R .RAMSAY,E.P.BRASS,F.
Literature Reference Citation J.ORG.CHEM.,57,3426(1992)
Literature Reference DOI 10.1021/jo00038a035
Molecular Weight 298.177 g/mol
Solvent CD3CN
Source File Reference UWCS3738