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IKGHIFGXPVLPFD-UHFFFAOYSA-N
SpectraBase Compound ID 6WTBfSIhLfe
InChI InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)
InChIKey IKGHIFGXPVLPFD-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKmTSfCwM6R
Name L-Phenylalanine, N-acetyl-, methyl ester
CAS Registry Number 3618-96-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)
InChIKey IKGHIFGXPVLPFD-UHFFFAOYSA-N
Molecular Weight 221.256 g/mol
SMILES N(C(C(=O)OC)Cc1ccccc1)C(=O)C
SPLASH splash10-03du-8900000000-4fecd1ca415fc2d15e27
Source of Spectrum AU-689-3699-0
Synonyms (S)-N-Acetyl-3-phenylalanine methyl ester 2-Acetamido-3-phenyl-propionic acid methyl ester 2-Acetamido-3-phenylpropanoic acid methyl ester Methyl 2-(acetylamino)-3-phenylpropanoate AC-PHE-OME Acetyl-L-phenylalanine methyl ester Acetyl-phenylalanine methyl ester Alanine, N-acetyl-3-phenyl-, methyl ester, L- Methyl 2-acetamido-3-phenyl-propanoate Methyl N-acetyl-L-phenylalaninate N-Acetyl-L-phenylalanine methyl ester N-acetyl-phenylalanine methyl ester
Wiley ID 1576126