DL-2-AMINO-N-BUTYRIC ACID METHYL ESTER HYDROCHLORIDE(7682-18-0) IR1
Molecular FormulaC5H12ClNO2
Molecular Weight153.61
InChIInChI=1S/C5H11NO2.ClH/c1-3-4(6)5(7)8-2;/h4H,3,6H2,1-2H3;1H
InChIKey AHAQQEGUPULIOZ-UHFFFAOYSA-N
SmilesC(N)(CC)C(=O)OC.Cl
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Assign. Shift(ppm)
A 8.81
B 3.941
C 3.749
D 1.872
E 0.929
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
169.62 711 1
52.97 942 2 *
52.51 962 3 *
23.20 806 4
9.09 1000 5
Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : nujol mull