VAL-THR(72636-02-3) 13C NMR
Product NameVAL-THR
CAS72636-02-3
Molecular FormulaC9H18N2O4
Molecular Weight218.25
InChIInChI=1S/C9H18N2O4/c1-4(2)6(10)8(13)11-7(5(3)12)9(14)15/h4-7,12H,10H2,1-3H3,(H,11,13)(H,14,15)/t5-,6+,7+/m1/s1
InChIKey GVRKWABULJAONN-VQVTYTSYSA-N
SmilesC(O)(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)N
-
ppm Int. Assign.
176.70 433 1 169.79 403 2 68.65 837 3 61.90 838 4 59.60 752 5 30.78 949 6 20.11 866 7 18.51 898 8 17.61 1000 8Spectral Code: 13C NMR : in D2O