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N-Carbobenzoxy-D,L-aspartic acid

View entire compound with spectra: 3 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

N-Carbobenzoxy-D,L-aspartic acid
SpectraBase Compound ID 6uJuiCY2c66
InChI InChI=1S/C12H13NO6/c14-10(15)6-9(11(16)17)13-12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,18)(H,14,15)(H,16,17)
InChIKey XYXYXSKSTZAEJW-UHFFFAOYSA-N
Mol Weight 267.24 g/mol
Molecular Formula C12H13NO6
Exact Mass 267.074287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1BTiOteqaaG
Name N-CARBOXY-DL-ASPARTIC ACID, N-BENZYL ESTER
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 4515-21-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO6
InChI InChI=1S/C12H13NO6/c14-10(15)6-9(11(16)17)13-12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,18)(H,14,15)(H,16,17)
InChIKey XYXYXSKSTZAEJW-UHFFFAOYSA-N
Melting Point 115C
Molecular Weight 267.24
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ASPARTIC ACID, N-CARBOXY-, N-BENZYL ESTER, DL-,