SER-MET(3227-09-6) 13C NMR
Molecular FormulaC8H16N2O4S
Molecular Weight236.29
InChIInChI=1S/C8H16N2O4S/c1-15-3-2-6(8(13)14)10-7(12)5(9)4-11/h5-6,11H,2-4,9H2,1H3,(H,10,12)(H,13,14)/t5-,6-/m0/s1
InChIKey PBUXMVYWOSKHMF-WDSKDSINSA-N
SmilesC(O)(=O)[C@H](CCSC)NC(=O)[C@H](CO)N
-
ppm Int. Assign.
178.48 137 1 168.03 156 2 61.06 869 3 55.62 1000 4 * 55.56 911 5 * 31.89 836 6 30.56 871 7 15.01 551 8Spectral Code: 13C NMR : in D2O