For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(Rs)-8-endo-Benzyl-8-exo-(p-tolylsulfinyl)methyl-7,9-dioxa-cis-bicyclo[4.3.0]nonane
SpectraBase Compound ID 1UHzDp98IpH
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
Mol Weight 370.51 g/mol
Molecular Formula C22H26O3S
Exact Mass 370.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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