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PARA-TOLUOYLTHREONINE-METHYLESTER

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PARA-TOLUOYLTHREONINE-METHYLESTER
SpectraBase Compound ID J7zGzJLuIaV
InChI InChI=1S/C13H17NO4/c1-8-4-6-10(7-5-8)12(16)14-11(9(2)15)13(17)18-3/h4-7,9,11,15H,1-3H3,(H,14,16)
InChIKey LHNSWOHGNBYEMA-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID zlQhdiUF53
Name P-Tolyl-threonine methyl ester
CAS Registry Number 57031-88-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-8-4-6-10(7-5-8)12(16)14-11(9(2)15)13(17)18-3/h4-7,9,11,15H,1-3H3,(H,14,16)
InChIKey LHNSWOHGNBYEMA-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference U. Hollstein, E. Breitmaier, G. Jung, J. Am. Chem. Soc. 96, 8036 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3