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L-N-CARBOXY-3-(METHYLTHIO)ALANINE, N-tert-BUTYL METHYL ESTER
SpectraBase Compound ID 9CQ0mfsIZDZ
InChI InChI=1S/C10H19NO4S/c1-10(2,3)15-9(13)11-7(6-16-5)8(12)14-4/h7H,6H2,1-5H3,(H,11,13)
InChIKey QSJXTKFREWNBLH-UHFFFAOYSA-N
Mol Weight 249.32 g/mol
Molecular Formula C10H19NO4S
Exact Mass 249.103479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbBS8VsF8sS
Name L-N-CARBOXY-3-(METHYLTHIO)ALANINE, N-tert-BUTYL METHYL ESTER
Source of Sample I. J. Climie, D. A. Evans Tetrahedron 38, 697(1982)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19NO4S
InChI InChI=1S/C10H19NO4S/c1-10(2,3)15-9(13)11-7(6-16-5)8(12)14-4/h7H,6H2,1-5H3,(H,11,13)
InChIKey QSJXTKFREWNBLH-UHFFFAOYSA-N
Molecular Weight 249.33
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
Synonyms ALANINE, N-CARBOXY-3-/METHYLTHIO/-, N-tert-BUTYL METHYL ESTER, L-,