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METHYL-O-HEXANOYL-(2R)-MANDELATE

View entire compound with spectra: 1 NMR

METHYL-O-HEXANOYL-(2R)-MANDELATE
SpectraBase Compound ID CbIRaX7lkOv
InChI InChI=1S/C15H20O4/c1-3-4-6-11-13(16)19-14(15(17)18-2)12-9-7-5-8-10-12/h5,7-10,14H,3-4,6,11H2,1-2H3/t14-/m1/s1/i1D3,4D,11D/t4-,11-,14-
InChIKey KGJNWIKMMDHWBB-YGXUQEHUSA-N
Mol Weight 269.35 g/mol
Molecular Formula C15H152H5O4
Exact Mass 269.167543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 55KcqKvN5cI
Name METHYL-O-HEXANOYL-(2R)-MANDELATE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H152H5O4
InChI InChI=1S/C15H20O4/c1-3-4-6-11-13(16)19-14(15(17)18-2)12-9-7-5-8-10-12/h5,7-10,14H,3-4,6,11H2,1-2H3/t14-/m1/s1/i1D3,4D,11D/t4-,11-,14-
InChIKey KGJNWIKMMDHWBB-YGXUQEHUSA-N
Literature Reference Author N.C.J.E.CHESTERS,D.O'HAGAN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,827(1997)
Literature Reference DOI 10.1039/a606589i
Molecular Weight 269.352 g/mol
Solvent CDCl3
Source File Reference UWRU11206