H-LYS-PHE-OH HCL(4078-58-4) 13C NMR
Molecular FormulaC15H24ClN3O3
Molecular Weight329.82
InChIInChI=1/C15H23N3O3.ClH/c16-9-5-4-8-12(17)14(19)18-13(15(20)21)10-11-6-2-1-3-7-11;/h1-3,6-7,12-13H,4-5,8-10,16-17H2,(H,18,19)(H,20,21);1H/t12-,13-;/s3
InChIKey BETNMOMENGHZHK-VRRSZUGLNA-N
SmilesC1(C=CC=CC=1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CCCCN.Cl |&1:7,14,r|
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ppm Int. Assign.
178.10 208 1
169.76 238 2
138.67 242 3
130.05 875 4
129.46 1000 5
127.67 430 6
57.59 364 7
53.88 394 8
39.91 420 9
38.23 348 10
31.18 404 11
27.07 483 12
21.73 466 13
Spectral Code: 13C NMR : in D2O