John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=10NCaKtsaW6 SpectraBase Spectrum ID=gA4nmlUDY2

(accessed ).
(-)-SAMARCANDONE
SpectraBase Compound ID 10NCaKtsaW6
InChI InChI=1S/C24H30O5/c1-22(2)18-9-12-24(4,27)19(23(18,3)11-10-20(22)25)14-28-16-7-5-15-6-8-21(26)29-17(15)13-16/h5-8,13,18-19,27H,9-12,14H2,1-4H3/t18-,19+,23-,24+/m1/s1
InChIKey KWFSFXRPFGONDD-LZFFWASXSA-N
Mol Weight 398.5 g/mol
Molecular Formula C24H30O5
Exact Mass 398.209324 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 gA4nmlUDY2
Name (-)-SAMARCANDONE
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30O5
InChI InChI=1S/C24H30O5/c1-22(2)18-9-12-24(4,27)19(23(18,3)11-10-20(22)25)14-28-16-7-5-15-6-8-21(26)29-17(15)13-16/h5-8,13,18-19,27H,9-12,14H2,1-4H3/t18-,19+,23-,24+/m1/s1
InChIKey KWFSFXRPFGONDD-LZFFWASXSA-N
Literature Reference Author A.A.AHMED,M.E.F.HEGAZY,A.ZELLAGUI,S.RHOUATI,T.A.MOHAMED,A.A. SAYED,M.A.ABDELLA,S.
Literature Reference Citation PHYTOCHEM.,68,680(2007)
Literature Reference DOI 10.1016/j.phytochem.2006.12.011
Molecular Weight 398.499 g/mol
Sample ID 42641
Solvent CDCl3
SpectraBase Batch ID DVut2b2iCkM