John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DCgSc0u2diG SpectraBase Spectrum ID=1iEBWg2mbr3

(accessed ).
12-ALPHA-ACETOXYFRAXINELLONE
SpectraBase Compound ID DCgSc0u2diG
InChI InChI=1S/C16H18O5/c1-9-4-5-12(20-10(2)17)16(3)13(9)15(18)21-14(16)11-6-7-19-8-11/h6-8,12,14H,4-5H2,1-3H3/t12-,14-,16+/m1/s1
InChIKey VUBZIJMZEMVHAO-XPKDYRNWSA-N
Mol Weight 290.31 g/mol
Molecular Formula C16H18O5
Exact Mass 290.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1iEBWg2mbr3
Name 12-ALPHA-ACETOXYFRAXINELLONE
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O5
InChI InChI=1S/C16H18O5/c1-9-4-5-12(20-10(2)17)16(3)13(9)15(18)21-14(16)11-6-7-19-8-11/h6-8,12,14H,4-5H2,1-3H3/t12-,14-,16+/m1/s1
InChIKey VUBZIJMZEMVHAO-XPKDYRNWSA-N
Literature Reference Author M.NAKATANI,R.C.HUANG,H.OKAMURA,T.IWAGAWA,K.TADERA
Literature Reference Citation PHYTOCHEM.,49,1773(1998)
Literature Reference DOI 10.1016/S0031-9422(98)00262-3
Molecular Weight 290.316 g/mol
Solvent CDCl3
Source File Reference UWLU692
SpectraBase Batch ID ACyvVzCPfx4