For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Alanyl-alanine cation
SpectraBase Compound ID 9gTaPTaXvR3
InChI InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/p+1
InChIKey DEFJQIDDEAULHB-UHFFFAOYSA-O
Mol Weight 161.18 g/mol
Molecular Formula C6H13N2O3
Exact Mass 161.092617 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4Ez1YO1kO0O
Name Alanyl-alanine cation
Comments LOCK:DNO3 ENRICHED,H2O 0.2M COND. FOR 1H COUPL. CONST.:H20,PH=2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H13N2O3
InChI InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/p+1
InChIKey DEFJQIDDEAULHB-UHFFFAOYSA-O
Instrument Name Bruker WH-180
Literature Reference T.B. Posner et. al., J. Chem. Soc. Chem. Comm. 769 (1975).
NMR Standard CH3NO2
Observed nucleus 15N
Solvent H2O