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(S)-N-(4-Methyl-3-pentenyl)phenylalanine Methyl Ester
SpectraBase Compound ID 67JbfxXUapY
InChI InChI=1S/C16H23NO2/c1-13(2)8-7-11-17-15(16(18)19-3)12-14-9-5-4-6-10-14/h4-6,8-10,15,17H,7,11-12H2,1-3H3/t15-/m0/s1
InChIKey ZKSFVLXEWYZFID-HNNXBMFYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TsyyTO0H4o
Name (S)-N-(4-Methyl-3-pentenyl)phenylalanine Methyl Ester
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Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-13(2)8-7-11-17-15(16(18)19-3)12-14-9-5-4-6-10-14/h4-6,8-10,15,17H,7,11-12H2,1-3H3/t15-/m0/s1
InChIKey ZKSFVLXEWYZFID-HNNXBMFYSA-N
Molecular Weight 261.365 g/mol
SMILES N([C@](C(=O)OC)(Cc1ccccc1)[H])CCC=C(C)C
SPLASH splash10-0f7p-9530000000-b05331e85a6190a1ad34
Source of Spectrum J-61-2833-7
Synonyms Methyl (2S)-2-[(4-methyl-3-pentenyl)amino]-3-phenylpropanoate (2S)-2-(4-methylpent-3-enylamino)-3-phenylpropanoic acid methyl ester Methyl (2S)-2-(4-methylpent-3-enylamino)-3-phenylpropanoate Methyl (2S)-2-(4-methylpent-3-enylamino)-3-phenyl-propanoate
Wiley ID 1264970