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(2S,.alpha.R)-3-Hydroxy-2-(.alpha.-methylbenzyl)aminopropyl benzoate
SpectraBase Compound ID KkJMlDttXQn
InChI InChI=1S/C18H21NO3/c1-14(15-8-4-2-5-9-15)19-17(12-20)13-22-18(21)16-10-6-3-7-11-16/h2-11,14,17,19-20H,12-13H2,1H3/t14-,17+/m1/s1
InChIKey MOOFSMMTUVRDCT-PBHICJAKSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DaZkmrKcB33
Name (2S,.alpha.R)-3-Hydroxy-2-(.alpha.-methylbenzyl)aminopropyl benzoate
Alternate Name(s) (2S)-3-hydroxy-2-{[(1R)-1-phenylethyl]amino}propyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-14(15-8-4-2-5-9-15)19-17(12-20)13-22-18(21)16-10-6-3-7-11-16/h2-11,14,17,19-20H,12-13H2,1H3/t14-,17+/m1/s1
InChIKey MOOFSMMTUVRDCT-PBHICJAKSA-N
Molecular Weight 299.370 g/mol
SMILES N([C@@](CO)(COC(=O)c1ccccc1)[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-0aor-0950000000-552615f62b2b18089cdf
Source of Spectrum KD-14-2158-2
Wiley ID 1636231