SpectraBase Spectrum ID |
3btqCzHO5Wr |
Name |
Bicyclo[2.1.1]hexane-2,3-diol, 5-(phenylthio)-, (1.alpha.,2.alpha.,3.alpha.,4.alpha.,5.beta.)- |
CAS Registry Number |
93099-25-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H14O2S |
InChI |
InChI=1S/C12H14O2S/c13-10-8-6-9(11(10)14)12(8)15-7-4-2-1-3-5-7/h1-5,8-14H,6H2/t8-,9+,10+,11-,12- |
InChIKey |
UNJKRNPDQWMCLF-CSPFCNMYSA-N |
Molecular Weight |
222.302 g/mol |
SMILES |
O[C@@]1([C@@]([C@]2([C@]([C@@]1(C2)[H])(Sc1ccccc1)[H])[H])(O)[H])[H] |
SPLASH |
splash10-014i-7900000000-4bec69dfdc88f28ad192 |
Source of Spectrum |
K-117-2980-0 |
Synonyms |
(1R,2R,3S,4S)-5-(phenylsulfanyl)bicyclo[2.1.1]hexane-2,3-diol
endo-5-(phenylthio)bicyclo[2.1.1]hexane-cis-2,3-diol |
Wiley ID |
1222123 |