| SpectraBase Spectrum ID |
5ecawz72yk1 |
| Name |
(1R,2S,5R,Ss)-1-{[(4-Methylphenyl)sulfenyl]methyl}-2-fluoro-5-methyl-6,8-dioxabicyclo[3.2.1]octane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H19FO3S |
| InChI |
InChI=1S/C15H19FO3S/c1-11-3-5-12(6-4-11)20(17)10-15-9-18-14(2,19-15)8-7-13(15)16/h3-6,13H,7-10H2,1-2H3/t13-,14+,15-,20?/m0/s1 |
| InChIKey |
FVNFGJLMOFKUCH-FHNOGEEDSA-N |
| Molecular Weight |
298.372 g/mol |
| SMILES |
[C@@]12(O[C@@](C)(OC2)CC[C@@]1(F)[H])C[S@@](c1ccc(cc1)C)=O |
| SPLASH |
splash10-000i-0090000000-2ab5a52437534ae38ca5 |
| Source of Spectrum |
J-66-8342-16 |
| Synonyms |
(1R,4S,5R)-4-fluoro-1-methyl-5-[[(S)-(4-methylphenyl)sulfinyl]methyl]-7,8-dioxabicyclo[3.2.1]octane
(1R,4S,5R)-4-fluoranyl-1-methyl-5-[[(S)-(4-methylphenyl)sulfinyl]methyl]-7,8-dioxabicyclo[3.2.1]octane |
| Wiley ID |
1568684 |
![(1R,2S,5R)-2-[[(4-METHYLPHENYL)-SULFINYL]-METHYL]-2-FLUORO-5-METHYL-6,8-DIOXABICYCLO-[3.2.1]-OCTANE](/api/spectrum/5ecawz72yk1/structure.png?h=300&w=458 "(1R,2S,5R)-2-[[(4-METHYLPHENYL)-SULFINYL]-METHYL]-2-FLUORO-5-METHYL-6,8-DIOXABICYCLO-[3.2.1]-OCTANE")
