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(2S)-2-(4-methylpent-3-enylamino)-3-phenyl-propionic acid 4-methylpent-3-enyl ester
SpectraBase Compound ID KuctzY6rZME
InChI InChI=1S/C21H31NO2/c1-17(2)10-8-14-22-20(16-19-12-6-5-7-13-19)21(23)24-15-9-11-18(3)4/h5-7,10-13,20,22H,8-9,14-16H2,1-4H3/t20-/m0/s1
InChIKey GGZDUFJVQBYTBI-FQEVSTJZSA-N
Mol Weight 329.48 g/mol
Molecular Formula C21H31NO2
Exact Mass 329.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9x4VtLpywoJ
Name (2S)-2-(4-methylpent-3-enylamino)-3-phenyl-propionic acid 4-methylpent-3-enyl ester
Alternate Name(s) (2S)-2-(4-methylpent-3-enylamino)-3-phenylpropanoic acid 4-methylpent-3-enyl ester 4-Methylpent-3-enyl (2S)-2-(4-methylpent-3-enylamino)-3-phenyl-propanoate
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Formula C21H31NO2
InChI InChI=1S/C21H31NO2/c1-17(2)10-8-14-22-20(16-19-12-6-5-7-13-19)21(23)24-15-9-11-18(3)4/h5-7,10-13,20,22H,8-9,14-16H2,1-4H3/t20-/m0/s1
InChIKey GGZDUFJVQBYTBI-FQEVSTJZSA-N
Molecular Weight 329.484 g/mol
SMILES N([C@](C(=O)OCCC=C(C)C)(Cc1ccccc1)[H])CCC=C(C)C
SPLASH splash10-0a60-9020000000-be9b67f23a78861fcb13
Source of Spectrum J-61-2833-8
Wiley ID 1327285