John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BPKnQqFXNcq SpectraBase Spectrum ID=2ABhmLM61Rs

(accessed ).
CONIOXEPINOL_D
SpectraBase Compound ID BPKnQqFXNcq
InChI InChI=1S/C16H14O8/c1-7-5-8(17)11-9(6-7)24-16(15(21)22-2)10(18)3-4-23-14(20)12(16)13(11)19/h3-6,10,17-18,20H,1-2H3/t10-,16-/m1/s1
InChIKey LQJKHXPYYJKORG-QLJPJBMISA-N
Mol Weight 334.28 g/mol
Molecular Formula C16H14O8
Exact Mass 334.068868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ABhmLM61Rs
Name CONIOXEPINOL_D
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14O8
InChI InChI=1S/C16H14O8/c1-7-5-8(17)11-9(6-7)24-16(15(21)22-2)10(18)3-4-23-14(20)12(16)13(11)19/h3-6,10,17-18,20H,1-2H3/t10-,16-/m1/s1
InChIKey LQJKHXPYYJKORG-QLJPJBMISA-N
Literature Reference Author Y.WANG,Z.ZHENG,S.LIU,H.ZHANG,E.LI,L.GUO,Y.CHE
Literature Reference Citation J.NAT.PROD.,73,920(2010)
Literature Reference DOI 10.1021/np100071z
Molecular Weight 334.282 g/mol
Sample ID 35551
Solvent CDCl3
SpectraBase Batch ID JfLCxjMFKHK