| SpectraBase Spectrum ID |
5brhCC2IV2a |
| Name |
1,3-Cyclobutanedimethanol, 2-(phenylthio)-, (1.alpha.,2.alpha.,3.alpha.)- |
| Alternate Name(s) |
cis-2-phenylthio-cis-1,3-cyclobutandimethanol
[(1R,3S)-3-(hydroxymethyl)-2-(phenylsulfanyl)cyclobutyl]methanol |
| CAS Registry Number |
85194-14-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O2S |
| InChI |
InChI=1S/C12H16O2S/c13-7-9-6-10(8-14)12(9)15-11-4-2-1-3-5-11/h1-5,9-10,12-14H,6-8H2/t9-,10+,12+ |
| InChIKey |
TVQGCVNRBLJSPO-IAZYJMLFSA-N |
| Molecular Weight |
224.318 g/mol |
| SMILES |
OC[C@@]1([C@]([C@](CO)(C1)[H])(Sc1ccccc1)[H])[H] |
| SPLASH |
splash10-03di-1900000000-e7f5368376ce1ebd3dd8 |
| Source of Spectrum |
K-116-678-0 |
| Wiley ID |
1224856 |
