SER-PHE(16875-28-8) 13C NMR
Product NameSER-PHE
CAS16875-28-8
Molecular FormulaC12H16N2O4
Molecular Weight252.27
InChIInChI=1S/C12H16N2O4/c13-9(7-15)11(16)14-10(12(17)18)6-8-4-2-1-3-5-8/h1-5,9-10,15H,6-7,13H2,(H,14,16)(H,17,18)/t9-,10-/m0/s1
InChIKey PPQRSMGDOHLTBE-UWVGGRQHSA-N
SmilesC(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)N
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ppm Int. Assign.
178.35 260 1 167.69 312 2 138.50 440 3 130.06 1000 4 129.45 977 5 127.70 523 6 60.95 532 7 57.65 557 8 55.36 526 9 38.21 508 10Spectral Code: 13C NMR : in D2O