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N-carboxy-L-alanine, N-tert-butyl ester

View entire compound with spectra: 44 NMR, 3 FTIR, and 6 MS (GC)

N-carboxy-L-alanine, N-tert-butyl ester
SpectraBase Compound ID 8WXQvwV13hV
InChI InChI=1S/C8H15NO4/c1-5(6(10)11)9-7(12)13-8(2,3)4/h5H,1-4H3,(H,9,12)(H,10,11)
InChIKey QVHJQCGUWFKTSE-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C8H15NO4
Exact Mass 189.100108 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2grEJ11sosK
Name N-T-Butoxycarbonyl-L-alanine
CAS Registry Number 15761-38-3
Comments (Z)-CONFIGURATION
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H15NO4
InChI InChI=1S/C8H15NO4/c1-5(6(10)11)9-7(12)13-8(2,3)4/h5H,1-4H3,(H,9,12)(H,10,11)
InChIKey QVHJQCGUWFKTSE-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference M. Branik, H. Kessler, Chem. Ber. 108, 2176 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3