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

*Links on SpectraBase are not permalinks.
CQTJGCQVQDQRDL-PYOZZTNRSA-N
SpectraBase Compound ID BaCY13vXCwr
InChI InChI=1S/C27H21ClO8/c1-34-21-11-18-17(19(12-29)25(21)28)5-6-20(31)24(18)26(33)35-16-9-14-3-2-4-23-27(36-23,22(32)13-30)8-7-15(14)10-16/h3,5-6,10-11,16,22-23,29-32H,9,12-13H2,1H3/b14-3-/t16-,22+,23+,27+/m1/s1
InChIKey CQTJGCQVQDQRDL-PYOZZTNRSA-N
Mol Weight 508.91 g/mol
Molecular Formula C27H21ClO8
Exact Mass 508.092495 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 KBCGlPShMnV
Name CQTJGCQVQDQRDL-PYOZZTNRSA-N
Compound Number 1-ENT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H21ClO8
InChI InChI=1S/C27H21ClO8/c1-34-21-11-18-17(19(12-29)25(21)28)5-6-20(31)24(18)26(33)35-16-9-14-3-2-4-23-27(36-23,22(32)13-30)8-7-15(14)10-16/h3,5-6,10-11,16,22-23,29-32H,9,12-13H2,1H3/b14-3-/t16-,22+,23+,27+/m1/s1
InChIKey CQTJGCQVQDQRDL-PYOZZTNRSA-N
Literature Reference Author S.KOBAYASHI,S.ASHIZAWA,Y.TAKAHASHI,Y.SUGIURA,M.NAGAOKA,M.J.L EAR,M.HIRAMA
Literature Reference Citation J.AM.CHEM.SOC.,123,11294(2001)
Literature Reference DOI 10.1021/ja011779v
Molecular Weight 508.912 g/mol
Solvent DMSO-D6:CD3CN=1:1
Source File Reference UWLU30827