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DL-Phenylalanine, N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylene]-, methyl ester, (E)-
SpectraBase Compound ID 1WUQwQndGol
InChI InChI=1S/C18H20N2O4/c1-12-17(22)15(14(11-21)9-19-12)10-20-16(18(23)24-2)8-13-6-4-3-5-7-13/h3-7,9-10,16,21-22H,8,11H2,1-2H3/b20-10+
InChIKey UKWISAJZXTTZNN-KEBDBYFISA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iq82IDPkmJb
Name DL-Phenylalanine, N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylene]-, methyl ester, (E)-
CAS Registry Number 122923-08-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-12-17(22)15(14(11-21)9-19-12)10-20-16(18(23)24-2)8-13-6-4-3-5-7-13/h3-7,9-10,16,21-22H,8,11H2,1-2H3/b20-10+
InChIKey UKWISAJZXTTZNN-KEBDBYFISA-N
Molecular Weight 328.368 g/mol
SMILES OCc1c(c(c(nc1)C)O)\C=N\C(C(=O)OC)Cc1ccccc1
SPLASH splash10-0079-9400000000-b09d48d76e6f56d669df
Source of Spectrum F-44-7290-0
Synonyms Methyl 2-({(E)-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylidene}amino)-3-phenylpropanoate N-pyridoxylidenephenylalanine methyl ester
Wiley ID 1326258