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(+/-)-2-METHOXY-GAMMA-AMINOBUTYRIC_ACID_BETAINE_METHYLESTER_CHLORIDE
SpectraBase Compound ID GbftRl9iwTV
InChI InChI=1S/C8H17NO3.ClH/c1-9(2,3)6-5-7(12-4)8(10)11;/h7H,5-6H2,1-4H3;1H
InChIKey PIGHQVHSXXKZQK-UHFFFAOYSA-N
Mol Weight 211.69 g/mol
Molecular Formula C8H18ClNO3
Exact Mass 211.097521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E4JXkyANqVQ
Name (+/-)-2-METHOXY-GAMMA-AMINOBUTYRIC_ACID_BETAINE_METHYLESTER_CHLORIDE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H18ClNO3
InChI InChI=1S/C8H17NO3.ClH/c1-9(2,3)6-5-7(12-4)8(10)11;/h7H,5-6H2,1-4H3;1H
InChIKey PIGHQVHSXXKZQK-UHFFFAOYSA-N
Literature Reference Author R.J.CAPON,D.VUONG,E.LACEY,J.H.GILL
Literature Reference Citation J.NAT.PROD.,68,179(2005)
Literature Reference DOI 10.1021/np049687h
Molecular Weight 211.689 g/mol
Solvent D2O
Source File Reference UWMZ8810