| SpectraBase Spectrum ID |
7y9gl17N5Em |
| Name |
(Threo)-3-phenylthio-1-tosyl-2-butanol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.085386849 u |
| Formula |
C17H20O3S2 |
| InChI |
InChI=1S/C17H20O3S2/c1-13-8-10-16(11-9-13)22(19,20)12-17(18)14(2)21-15-6-4-3-5-7-15/h3-11,14,17-18H,12H2,1-2H3/t14-,17+/m1/s1 |
| InChIKey |
MKERSQZTNZQRIY-PBHICJAKSA-N |
| Molecular Weight |
336.464 g/mol |
| SMILES |
C(S(C=1C=CC(=CC1)C)(=O)=O)[C@@]([C@](SC1=CC=CC=C1)(C)[H])(O)[H] |
