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N-Carbobenzoxy-DL-valine

View entire compound with spectra: 7 NMR, 4 FTIR, 1 Raman, and 6 MS (GC)

N-Carbobenzoxy-DL-valine
SpectraBase Compound ID mCLqqr5t0h
InChI InChI=1S/C13H17NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)
InChIKey CANZBRDGRHNSGZ-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 KKp9LPmd23k
Name N-CARBOXY-DL-VALINE, N-BENZYL ESTER
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 3588-63-4
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)
InChIKey CANZBRDGRHNSGZ-UHFFFAOYSA-N
Melting Point 78C
Molecular Weight 251.28
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms VALINE, N-CARBOXY-, N-BENZYL ESTER, DL-,