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

*Links on SpectraBase are not permalinks.
(4S,5R,6S,7S)-4,5:6,7-BIS-(IOSPROPYLIDENEDIOXY)-2-CYCLOHEPTEN-1-ONE
SpectraBase Compound ID 2aC1dmkUSaT
InChI InChI=1S/C13H18O5/c1-12(2)15-8-6-5-7(14)9-11(10(8)17-12)18-13(3,4)16-9/h5-6,8-11H,1-4H3/t8-,9+,10+,11+/m0/s1
InChIKey JJISMLIHVKKEPT-LNFKQOIKSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 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 5MQ6i2u9Z9Y
Name (4S,5R,6S,7S)-4,5:6,7-BIS-(IOSPROPYLIDENEDIOXY)-2-CYCLOHEPTEN-1-ONE
Compound Number 71
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-12(2)15-8-6-5-7(14)9-11(10(8)17-12)18-13(3,4)16-9/h5-6,8-11H,1-4H3/t8-,9+,10+,11+/m0/s1
InChIKey JJISMLIHVKKEPT-LNFKQOIKSA-N
Literature Reference Author J.MARCO-CONTELLES,E.D.OPAZO
Literature Reference Citation J.ORG.CHEM.,67,3705(2002)
Literature Reference DOI 10.1021/jo0111107
Molecular Weight 254.283 g/mol
Solvent CDCl3
Source File Reference UWLU25722