SpectraBase Spectrum ID |
BpM8CtcfVxI |
Name |
(Rs)-3-exo-Benzyl-3-endo-(p-tolylsulfinyl)methyl-2,4-dioxa-cis-bicyclo[3.3.0]octane |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H24O3S |
InChI |
InChI=1S/C21H24O3S/c1-16-10-12-18(13-11-16)25(22)15-21(14-17-6-3-2-4-7-17)23-19-8-5-9-20(19)24-21/h2-4,6-7,10-13,19-20H,5,8-9,14-15H2,1H3/t19-,20+,21-,25? |
InChIKey |
DOMYDICUWMSODL-OVZPOALRSA-N |
Molecular Weight |
356.480 g/mol |
SMILES |
[C@]1(C[S@](c2ccc(cc2)C)=O)(O[C@@]2(CCC[C@@]2(O1)[H])[H])Cc1ccccc1 |
SPLASH |
splash10-03di-0090000000-c0fd93c0d0bdf728e57f |
Source of Spectrum |
F-52-6535-6 |
Synonyms |
(2S,3aR,6aS)-2-Benzyl-2-((R)-toluene-4-sulfinylmethyl)-tetrahydro-cyclopenta[1,3]dioxole
(3aR,6aS)-2-benzyl-2-{[(4-methylphenyl)sulfinyl]methyl}tetrahydro-3aH-cyclopenta[d][1,3]dioxole
[(3aR,6aS)-2-benzyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-2-yl]methyl 4-methylphenyl sulfoxide |
Wiley ID |
796603 |