(1S,2S)-1-(4-methylsulfanylphenyl)-2-[(phenylmethyl)amino]propane-1,3-diol

SpectraBase Compound ID	6j2p1QfXrbn
InChI	InChI=1S/C17H21NO2S/c1-21-15-9-7-14(8-10-15)17(20)16(12-19)18-11-13-5-3-2-4-6-13/h2-10,16-20H,11-12H2,1H3/t16-,17-/m0/s1
InChIKey	XVQMBLAYQPMXLB-IRXDYDNUSA-N Google Search
Mol Weight	303.42 g/mol
Molecular Formula	C17H21NO2S
Exact Mass	303.1293 g/mol

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SpectraBase Spectrum ID	4bHBNPZ9NVz
Name	(1S,2S)-1-(4-methylsulfanylphenyl)-2-[(phenylmethyl)amino]propane-1,3-diol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H21NO2S
InChI	InChI=1S/C17H21NO2S/c1-21-15-9-7-14(8-10-15)17(20)16(12-19)18-11-13-5-3-2-4-6-13/h2-10,16-20H,11-12H2,1H3/t16-,17-/m0/s1
InChIKey	XVQMBLAYQPMXLB-IRXDYDNUSA-N
Molecular Weight	303.420 g/mol
SMILES	N([C@@](CO)([C@](c1ccc(cc1)SC)(O)[H])[H])Cc1ccccc1
SPLASH	splash10-0udl-6900000000-c6aac3d507c36976fce3
Source of Spectrum	QC-11-3021-3
Synonyms	(1S,2S)-1-[4-(methylthio)phenyl]-2-[(phenylmethyl)amino]propane-1,3-diol (1S,2S)-2-(benzylamino)-1-(4-methylsulfanylphenyl)propane-1,3-diol (1S,2S)-2-(benzylamino)-1-[4-(methylthio)phenyl]propane-1,3-diol
Wiley ID	860017