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

*Links on SpectraBase are not permalinks.
3-CHLORO-3'-HYDROXYCANTHAXANTHIN
SpectraBase Compound ID IKD0vojEiTt
InChI InChI=1S/C40H51ClO3/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+
InChIKey ZVSCLRFAGMFRKL-QISQUURKSA-N
Mol Weight 615.3 g/mol
Molecular Formula C40H51ClO3
Exact Mass 614.352673 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 3XaoNW87OTB
Name 3-CHLORO-3'-HYDROXYCANTHAXANTHIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H51ClO3
InChI InChI=1S/C40H51ClO3/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+
InChIKey ZVSCLRFAGMFRKL-QISQUURKSA-N
Literature Reference Author J.LIU,N.L.SHELTON,R.S.H.LIU
Literature Reference Citation ORG.LETTERS,4,2521(2002)
Literature Reference DOI 10.1021/ol026146f
Molecular Weight 615.296 g/mol
Sample ID 28366
Solvent CDCl3