John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=C1CCCP3oNY2 SpectraBase Spectrum ID=2AiDlrxgwWA

(accessed ).
3-HYDROXY-2-METHYLBUTANOYL-CARNITINE
SpectraBase Compound ID C1CCCP3oNY2
InChI InChI=1S/C12H23NO5/c1-8(9(2)14)12(17)18-10(6-11(15)16)7-13(3,4)5/h8-10,14H,6-7H2,1-5H3/t8?,9?,10-/m1/s1
InChIKey BFUHRGXPEKKLCB-UDNWOFFPSA-N
Mol Weight 261.32 g/mol
Molecular Formula C12H23NO5
Exact Mass 261.157623 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AiDlrxgwWA
Name 3-HYDROXY-2-METHYLBUTANOYL-CARNITINE
Compound Number 6
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H23NO5
InChI InChI=1S/C12H23NO5/c1-8(9(2)14)12(17)18-10(6-11(15)16)7-13(3,4)5/h8-10,14H,6-7H2,1-5H3/t8?,9?,10-/m1/s1
InChIKey BFUHRGXPEKKLCB-UDNWOFFPSA-N
Literature Reference Author H.KAWAGISHI,H.MURAKAMI,S.SAKAI,S.INOUE
Literature Reference Citation PHYTOCHEM.,67,2676(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.09.014
Molecular Weight 261.318 g/mol
Sample ID 67182
Solvent D2O
SpectraBase Batch ID BGxRQHg8UO2