| SpectraBase Spectrum ID |
9mMUal9qIOU |
| Name |
(Rs)-3-endo-Phenyl-3-exo-(p-tolylsulfinyl)methyl-2,4-dioxa-cis-bicyclo[3.3.0]octane |
| Alternate Name(s) |
(2R,3aR,6aS)-2-Phenyl-2-((R)-toluene-4-sulfinylmethyl)-tetrahydro-cyclopenta[1,3]dioxole
(3aR,6aS)-2-{[(4-methylphenyl)sulfinyl]methyl}-2-phenyltetrahydro-3aH-cyclopenta[d][1,3]dioxole
[(3aR,6aS)-2-phenyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-2-yl]methyl 4-methylphenyl sulfoxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22O3S |
| InChI |
InChI=1S/C20H22O3S/c1-15-10-12-17(13-11-15)24(21)14-20(16-6-3-2-4-7-16)22-18-8-5-9-19(18)23-20/h2-4,6-7,10-13,18-19H,5,8-9,14H2,1H3/t18-,19+,20-,24? |
| InChIKey |
FKYMENGLPWKANI-GUHGBLDKSA-N |
| Molecular Weight |
342.453 g/mol |
| SMILES |
[C@]1(C[S@](c2ccc(cc2)C)=O)(O[C@@]2(CCC[C@@]2(O1)[H])[H])c1ccccc1 |
| SPLASH |
splash10-004i-0900000000-09cca339f2ec3a9e33e0 |
| Source of Spectrum |
F-52-6534-5 |
| Wiley ID |
796605 |
![(Rs)-3-endo-Phenyl-3-exo-(p-tolylsulfinyl)methyl-2,4-dioxa-cis-bicyclo[3.3.0]octane](/api/spectrum/9mMUal9qIOU/structure.png?h=300&w=458 "(Rs)-3-endo-Phenyl-3-exo-(p-tolylsulfinyl)methyl-2,4-dioxa-cis-bicyclo[3.3.0]octane")
