H-TYR-TYR-OH(1050-28-8) 13C NMR
Product NameH-TYR-TYR-OH
CAS1050-28-8
Molecular FormulaC18H20N2O5
Molecular Weight344.36
InChIInChI=1S/C18H20N2O5/c19-15(9-11-1-5-13(21)6-2-11)17(23)20-16(18(24)25)10-12-3-7-14(22)8-4-12/h1-8,15-16,21-22H,9-10,19H2,(H,20,23)(H,24,25)/t15-,16-/m0/s1
InChIKey JAQGKXUEKGKTKX-HOTGVXAUSA-N
SmilesC(O)(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC1=CC=C(O)C=C1)N
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ppm Int. Assign.
177.96 320 1 168.98 365 2 155.92 363 3 154.97 345 4 131.64 982 5 * 131.37 981 6 * 130.28 434 7 126.31 444 8 116.75 939 9 # 116.15 1000 10 # 57.79 452 11 55.24 463 12 37.46 388 13 36.68 394 14Spectral Code: 13C NMR : in D2O