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(2S,.alpha.R)-3-Hydroxy-2-(.alpha.-methylbenzyl)aminopropyl benzoate hydrochloride
SpectraBase Compound ID 4PzQDSZenUZ
InChI InChI=1S/C18H21NO3.ClH/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;1H/t14-,17+;/m1./s1
InChIKey FWDLYWMRBLZBNC-CVLQQERVSA-N
Mol Weight 335.83 g/mol
Molecular Formula C18H22ClNO3
Exact Mass 335.128821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Dp7Lq4ctHJ
Name (2S,.alpha.R)-3-Hydroxy-2-(.alpha.-methylbenzyl)aminopropyl benzoate hydrochloride
Alternate Name(s) (2S)-3-hydroxy-2-{[(1R)-1-phenylethyl]amino}propyl benzoate hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22ClNO3
InChI InChI=1S/C18H21NO3.ClH/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;1H/t14-,17+;/m1./s1
InChIKey FWDLYWMRBLZBNC-CVLQQERVSA-N
Molecular Weight 335.831 g/mol
SMILES Cl.N([C@@](CO)(COC(=O)c1ccccc1)[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-0a4i-1930000000-7b82c922ddc2bbd7ce73
Source of Spectrum KD-14-2157-2
Wiley ID 1636233