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Benzyl (3S)-4-methyl-3-[(1'-phenylethyl)amino]pentanoate
SpectraBase Compound ID 2S2lPCFFL3a
InChI InChI=1S/C21H27NO2/c1-16(2)20(22-17(3)19-12-8-5-9-13-19)14-21(23)24-15-18-10-6-4-7-11-18/h4-13,16-17,20,22H,14-15H2,1-3H3/t17?,20-/m0/s1
InChIKey LQWCKKUDHWIQAG-OZBJMMHXSA-N
Mol Weight 325.45 g/mol
Molecular Formula C21H27NO2
Exact Mass 325.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3R02ZgNPIu
Name Benzyl (3S)-4-methyl-3-[(1'-phenylethyl)amino]pentanoate
Alternate Name(s) benzyl (3S)-4-methyl-3-[(1-phenylethyl)amino]pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO2
InChI InChI=1S/C21H27NO2/c1-16(2)20(22-17(3)19-12-8-5-9-13-19)14-21(23)24-15-18-10-6-4-7-11-18/h4-13,16-17,20,22H,14-15H2,1-3H3/t17?,20-/m0/s1
InChIKey LQWCKKUDHWIQAG-OZBJMMHXSA-N
Molecular Weight 325.452 g/mol
SMILES N([C@@](CC(=O)OCc1ccccc1)(C(C)C)[H])C(c1ccccc1)C
SPLASH splash10-0560-0950000000-85f434960c812c4ccf9c
Source of Spectrum SK-31-2947-0
Wiley ID 882277