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N-Benzoyl-L-threonine methyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

N-Benzoyl-L-threonine methyl ester
SpectraBase Compound ID GiBc47rcujv
InChI InChI=1S/C12H15NO4/c1-8(14)10(12(16)17-2)13-11(15)9-6-4-3-5-7-9/h3-8,10,14H,1-2H3,(H,13,15)/t8-,10+/m1/s1
InChIKey KHOWDUMYRBCHAC-SCZZXKLOSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6aIWroIJm7S
Name N-Benzoyl-L-threonine methyl ester
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 281107
CAS Registry Number 79893-89-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-8(14)10(12(16)17-2)13-11(15)9-6-4-3-5-7-9/h3-8,10,14H,1-2H3,(H,13,15)/t8-,10+/m1/s1
InChIKey KHOWDUMYRBCHAC-SCZZXKLOSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (2S,3R)-Methyl 2-benzamido-3-hydroxybutanoate N-alpha-Benzoyl-L-threonine methyl ester (2S 3R)-(+)-N-BENZOYLTHREONINEETHYL ESTER
Wiley ID SIAL_13CNMR_005219