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(3S)-3-hydroxy-5-oxo-5-[(phenylmethyl)amino]pentanoic acid methyl ester
SpectraBase Compound ID Fiz8jxKC3yh
InChI InChI=1S/C13H17NO4/c1-18-13(17)8-11(15)7-12(16)14-9-10-5-3-2-4-6-10/h2-6,11,15H,7-9H2,1H3,(H,14,16)/t11-/m0/s1
InChIKey PZZWRSWATBAQFM-NSHDSACASA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SMzUki5YUD
Name (3S)-3-hydroxy-5-oxo-5-[(phenylmethyl)amino]pentanoic acid methyl ester
Alternate Name(s) (3S)-5-(benzylamino)-3-hydroxy-5-keto-valeric acid methyl ester Methyl (3S)-3-oxidanyl-5-oxidanylidene-5-[(phenylmethyl)amino]pentanoate Methyl (3S)-5-(benzylamino)-3-hydroxy-5-oxo-pentanoate
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Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-18-13(17)8-11(15)7-12(16)14-9-10-5-3-2-4-6-10/h2-6,11,15H,7-9H2,1H3,(H,14,16)/t11-/m0/s1
InChIKey PZZWRSWATBAQFM-NSHDSACASA-N
Molecular Weight 251.282 g/mol
SMILES O[C@@](CC(NCc1ccccc1)=O)(CC(=O)OC)[H]
SPLASH splash10-0a4l-5910000000-d0cd136e46ab7c3e5168
Source of Spectrum J-61-6025-3
Wiley ID 1254513