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

*Links on SpectraBase are not permalinks.
BENZYL-4-O-BUTANOYLQUINATE;BENZYL-4-ALPHA-(BUTANOYLOXY)-1-ALPHA,3-ALPHA,5-BETA-TRIHYDROXYCYCLOHEXANE-1-BETA-CARBOXYLATE
SpectraBase Compound ID C5V9lklnMGr
InChI InChI=1S/C18H24O7/c1-2-6-15(21)25-16-13(19)9-18(23,10-14(16)20)17(22)24-11-12-7-4-3-5-8-12/h3-5,7-8,13-14,16,19-20,23H,2,6,9-11H2,1H3/t13-,14-,16-,18+/m1/s1
InChIKey BQEZPVWFFMEKLV-SZXPJGKVSA-N
Mol Weight 352.38 g/mol
Molecular Formula C18H24O7
Exact Mass 352.152203 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 2rOt95tS3ve
Name BENZYL-4-O-BUTANOYLQUINATE;BENZYL-4-ALPHA-(BUTANOYLOXY)-1-ALPHA,3-ALPHA,5-BETA-TRIHYDROXYCYCLOHEXANE-1-BETA-CARBOXYLATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24O7
InChI InChI=1S/C18H24O7/c1-2-6-15(21)25-16-13(19)9-18(23,10-14(16)20)17(22)24-11-12-7-4-3-5-8-12/h3-5,7-8,13-14,16,19-20,23H,2,6,9-11H2,1H3/t13-,14-,16-,18+/m1/s1
InChIKey BQEZPVWFFMEKLV-SZXPJGKVSA-N
Literature Reference Author B.DANIELI,P.DEBELLIS,L.BARZAGHI,G.CARREA,G.OTTOLINA,S.RIVA
Literature Reference Citation HELV.CHIM.ACTA,75,1297(1992)
Literature Reference DOI 10.1002/hlca.19920750431
Molecular Weight 352.384 g/mol
Solvent DMSO-D6
Source File Reference UWCS5295