SpectraBase Spectrum ID |
3qbhmHgQxWY |
Name |
(Rs)-8-exo-Benzyl-8-endo-(p-tolylsulfinyl)methyl-7,9-dioxa-cis-bicyclo[4.3.0]nonane |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H26O3S |
InChI |
InChI=1S/C22H26O3S/c1-17-11-13-19(14-12-17)26(23)16-22(15-18-7-3-2-4-8-18)24-20-9-5-6-10-21(20)25-22/h2-4,7-8,11-14,20-21H,5-6,9-10,15-16H2,1H3/t20-,21+,22?,26? |
InChIKey |
KCRYUUMCUOMUNE-MYWYYWIJSA-N |
Molecular Weight |
370.507 g/mol |
SMILES |
C1(CS(c2ccc(cc2)C)=O)(O[C@@]2(CCCC[C@@]2(O1)[H])[H])Cc1ccccc1 |
SPLASH |
splash10-004i-0091000000-5cabdfbfe6ba0455a9a5 |
Source of Spectrum |
F-52-6535-7 |
Synonyms |
(3aR,7aS)-2-benzyl-2-{[(4-methylphenyl)sulfinyl]methyl}hexahydro-1,3-benzodioxole
(Rs)-8-endo-Benzyl-8-exo-(p-tolylsulfinyl)methyl-7,9-dioxa-cis-bicyclo[4.3.0]nonane
[(3aR,7aS)-2-benzylhexahydro-1,3-benzodioxol-2-yl]methyl 4-methylphenyl sulfoxide |
Wiley ID |
796601 |