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N-Acetyl-L-tyrosine, ethyl ester

View entire compound with spectra: 1 FTIR, 1 Raman, and 1 MS (GC)

N-Acetyl-L-tyrosine, ethyl ester
SpectraBase Compound ID J0JNQrX7oWZ
InChI InChI=1S/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)/t12-/m0/s1
InChIKey SKAWDTAMLOJQNK-LBPRGKRZSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Br56SS5Vu4
Name (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoic acid ethyl ester
Alternate Name(s) (2S)-2-acetamido-3-(4-hydroxyphenyl)propionic acid ethyl ester Ethyl (2S)-2-(acetylamino)-3-(4-hydroxyphenyl)propanoate Ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate
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Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)/t12-/m0/s1
InChIKey SKAWDTAMLOJQNK-LBPRGKRZSA-N
Molecular Weight 251.282 g/mol
SMILES N([C@@](Cc1ccc(cc1)O)(C(=O)OCC)[H])C(=O)C
SPLASH splash10-052f-3900000000-4b260f78d0bdc25b9b4d
Source of Spectrum PG-1982-1805-0
Wiley ID 1254471