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EPICACALONE
SpectraBase Compound ID 4Ykt664poGb
InChI InChI=1S/C15H18O3/c1-8-5-4-6-10-11(8)15(3,17)12-9(2)7-18-14(12)13(10)16/h7-8,17H,4-6H2,1-3H3/t8-,15-/m0/s1
InChIKey VNNQNPHIASWXBS-AYVTZFPOSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVYOTZXQLRj
Name EPICACALONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-8-5-4-6-10-11(8)15(3,17)12-9(2)7-18-14(12)13(10)16/h7-8,17H,4-6H2,1-3H3/t8-,15-/m0/s1
InChIKey VNNQNPHIASWXBS-AYVTZFPOSA-N
Literature Reference Author M.FRAGOSO-SERRANO,G.FIGUEROA-GONZALEZ,E.CASTRO-CARRANZA,F.HE RNANDEZ-SOLIS,E.LINA
Literature Reference Citation J.NAT.PROD.,75,890(2012)
Literature Reference DOI 10.1021/np2009412
Molecular Weight 246.306 g/mol
Sample ID 40407
Solvent CDCl3