| SpectraBase Spectrum ID |
4bHBNPZ9NVz |
| Name |
(1S,2S)-1-(4-methylsulfanylphenyl)-2-[(phenylmethyl)amino]propane-1,3-diol |
| Alternate Name(s) |
(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 |
| 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 |
| Wiley ID |
860017 |
![(1S,2S)-1-(4-methylsulfanylphenyl)-2-[(phenylmethyl)amino]propane-1,3-diol](/api/spectrum/4bHBNPZ9NVz/structure.png?h=300&w=458 "(1S,2S)-1-(4-methylsulfanylphenyl)-2-[(phenylmethyl)amino]propane-1,3-diol")
