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

*Links on SpectraBase are not permalinks.
#9;(-)-(3AR,4R,7S,7AS)-2-ALLYL-3A-[(R)-[[(1R,2R,4R)-2-HYDROXY-7,7-DIMETHYLBICYCLO-[2.2.1]-HEPTAN-1-YL]-METHYL]-SULFINYL]-3A,4,7,7A-TETRAHYDRO-1H-4,7-METHANOISO
SpectraBase Compound ID 4RZxEgE29zo
InChI InChI=1S/C22H29NO4S/c1-4-9-23-18(25)17-13-5-6-15(10-13)22(17,19(23)26)28(27)12-21-8-7-14(11-16(21)24)20(21,2)3/h4-6,13-17,24H,1,7-12H2,2-3H3/t13-,14-,15+,16-,17-,21-,22+,28?/m1/s1
InChIKey VWMWSVKJJAPFCP-JAEZUGHBSA-N
Mol Weight 403.54 g/mol
Molecular Formula C22H29NO4S
Exact Mass 403.18173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HVrbRNtNWHn
Name #9;(-)-(3AR,4R,7S,7AS)-2-ALLYL-3A-[(R)-[[(1R,2R,4R)-2-HYDROXY-7,7-DIMETHYLBICYCLO-[2.2.1]-HEPTAN-1-YL]-METHYL]-SULFINYL]-3A,4,7,7A-TETRAHYDRO-1H-4,7-METHANOISO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO4S
InChI InChI=1S/C22H29NO4S/c1-4-9-23-18(25)17-13-5-6-15(10-13)22(17,19(23)26)28(27)12-21-8-7-14(11-16(21)24)20(21,2)3/h4-6,13-17,24H,1,7-12H2,2-3H3/t13-,14-,15+,16-,17-,21-,22+,28?/m1/s1
InChIKey VWMWSVKJJAPFCP-JAEZUGHBSA-N
Literature Reference Author A.GOMEZ-SANJUAN,N.SOTOMAYOR,E.LETE
Literature Reference Citation EUR.J.ORG.CHEM.,2013,6722(2013)
Literature Reference DOI 10.1002/ejoc.201300889
Molecular Weight 403.537 g/mol
Solvent CDCl3
Source File Reference UWBT18479