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(2S)-3-(3-acetyl-4-hydroxy-phenyl)-2-amino-propionic acid methyl ester
SpectraBase Compound ID 10LndmZdd7L
InChI InChI=1S/C12H15NO4/c1-7(14)9-5-8(3-4-11(9)15)6-10(13)12(16)17-2/h3-5,10,15H,6,13H2,1-2H3/t10-/m0/s1
InChIKey VQVRSJSGFRNIAN-JTQLQIEISA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FulBjzpTxdl
Name (2S)-3-(3-acetyl-4-hydroxy-phenyl)-2-amino-propionic acid methyl ester
Alternate Name(s) (2S)-3-(3-acetyl-4-hydroxyphenyl)-2-aminopropanoic acid methyl ester Methyl (2S)-2-azanyl-3-(3-ethanoyl-4-oxidanyl-phenyl)propanoate Methyl (2S)-3-(3-acetyl-4-hydroxy-phenyl)-2-amino-propanoate
CAS Registry Number 57085-32-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-7(14)9-5-8(3-4-11(9)15)6-10(13)12(16)17-2/h3-5,10,15H,6,13H2,1-2H3/t10-/m0/s1
InChIKey VQVRSJSGFRNIAN-JTQLQIEISA-N
Molecular Weight 237.255 g/mol
SMILES N[C@@](Cc1cc(c(cc1)O)C(=O)C)(C(=O)OC)[H]
SPLASH splash10-0002-3900000000-df2c0697ce8987349aa3
Source of Spectrum J-52-5285-11
Wiley ID 1239455