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syn,anti-Methyl 2-(1-(Benzylaminoethyl)-3-hydroxybutanoate
SpectraBase Compound ID IryFuvVXkWG
InChI InChI=1S/C14H21NO3/c1-11(16)13(14(17)18-2)8-9-15-10-12-6-4-3-5-7-12/h3-7,11,13,15-16H,8-10H2,1-2H3
InChIKey JGNJXWYXCHOBBP-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5aIErf3T8Th
Name syn,anti-Methyl 2-(1-(Benzylaminoethyl)-3-hydroxybutanoate
Alternate Name(s) methyl 2-[2-(benzylamino)ethyl]-3-hydroxybutanoate
Comments Less than 3 mono-isotopic peaks
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Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-11(16)13(14(17)18-2)8-9-15-10-12-6-4-3-5-7-12/h3-7,11,13,15-16H,8-10H2,1-2H3
InChIKey JGNJXWYXCHOBBP-UHFFFAOYSA-N
Molecular Weight 251.326 g/mol
SMILES OC(C(CCNCc1ccccc1)C(=O)OC)C
SPLASH splash10-0006-9000000000-a7c03c4e9038d79c0aee
Source of Spectrum J-60-6521-5
Wiley ID 1254598