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(2S)-2-[benzyl(4-methylpent-3-enyl)amino]-4-methyl-valeric acid methyl ester
SpectraBase Compound ID Cx25h1XUfvZ
InChI InChI=1S/C20H31NO2/c1-16(2)10-9-13-21(15-18-11-7-6-8-12-18)19(14-17(3)4)20(22)23-5/h6-8,10-12,17,19H,9,13-15H2,1-5H3/t19-/m0/s1
InChIKey WNNAVFYTLUPVIB-IBGZPJMESA-N
Mol Weight 317.47 g/mol
Molecular Formula C20H31NO2
Exact Mass 317.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtLAWrTXU5A
Name (2S)-2-[benzyl(4-methylpent-3-enyl)amino]-4-methyl-valeric acid methyl ester
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Formula C20H31NO2
InChI InChI=1S/C20H31NO2/c1-16(2)10-9-13-21(15-18-11-7-6-8-12-18)19(14-17(3)4)20(22)23-5/h6-8,10-12,17,19H,9,13-15H2,1-5H3/t19-/m0/s1
InChIKey WNNAVFYTLUPVIB-IBGZPJMESA-N
Molecular Weight 317.473 g/mol
SMILES [C@](N(Cc1ccccc1)CCC=C(C)C)(C(=O)OC)(CC(C)C)[H]
SPLASH splash10-014i-0419000000-1deb8998a079fae1be18
Source of Spectrum J-61-2834-9
Synonyms (2S)-4-methyl-2-[4-methylpent-3-enyl-(phenylmethyl)amino]pentanoic acid methyl ester Methyl (2S)-2-[benzyl(4-methylpent-3-enyl)amino]-4-methyl-pentanoate Methyl (2S)-4-methyl-2-[4-methylpent-3-enyl-(phenylmethyl)amino]pentanoate
Wiley ID 1317851