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

*Links on SpectraBase are not permalinks.
9-(ORTHO-TOLYLTHIO)-PAEONILACTONE-A
SpectraBase Compound ID 92b3PMApiNr
InChI InChI=1S/C17H20O4S/c1-10-5-3-4-6-14(10)22-9-12-11-7-15(18)17(2,20)8-13(11)21-16(12)19/h3-6,11-13,20H,7-9H2,1-2H3/t11-,12-,13-,17+/m1/s1
InChIKey GMQWNEPSHHJKAG-ZFRZLUBXSA-N
Mol Weight 320.4 g/mol
Molecular Formula C17H20O4S
Exact Mass 320.10823 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 3re4xJC9Vp4
Name 9-(ORTHO-TOLYLTHIO)-PAEONILACTONE-A
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O4S
InChI InChI=1S/C17H20O4S/c1-10-5-3-4-6-14(10)22-9-12-11-7-15(18)17(2,20)8-13(11)21-16(12)19/h3-6,11-13,20H,7-9H2,1-2H3/t11-,12-,13-,17+/m1/s1
InChIKey GMQWNEPSHHJKAG-ZFRZLUBXSA-N
Literature Reference Author A.A.ABDEL-HAFEZ,M.R.MESELHY,N.NAKAMURA,M.HATTORI,M.A.EL-GEND Y,N.M.MAHFOUZ,T.A.MO
Literature Reference Citation CHEM.PHARM.BULL.,49,918(2001)
Literature Reference DOI 10.1248/cpb.49.918
Molecular Weight 320.403 g/mol
Solvent CDCl3
Source File Reference UWLU31821