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O-ACETYL-1-HYDROXY-2-METHOXY-1,2,3,4-DEHYDROCACALONE
SpectraBase Compound ID 5nfYo1s0Nb5
InChI InChI=1S/C18H18O6/c1-8-6-11(22-5)15(20)12-13(8)18(4,24-10(3)19)14-9(2)7-23-17(14)16(12)21/h6-7,20H,1-5H3
InChIKey PNTHREYKXSVFOA-UHFFFAOYSA-N
Mol Weight 330.34 g/mol
Molecular Formula C18H18O6
Exact Mass 330.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kq5OFNp4dxH
Name O-ACETYL-1-HYDROXY-2-METHOXY-1,2,3,4-DEHYDROCACALONE
Compound Number 12
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18O6
InChI InChI=1S/C18H18O6/c1-8-6-11(22-5)15(20)12-13(8)18(4,24-10(3)19)14-9(2)7-23-17(14)16(12)21/h6-7,20H,1-5H3
InChIKey PNTHREYKXSVFOA-UHFFFAOYSA-N
Literature Reference Author E.BURGUENO-TAPIA,M.A.BUCIO,A.RIVERA,P.JOSEPH-NATHAN
Literature Reference Citation J.NAT.PROD.,64,518(2001)
Literature Reference DOI 10.1021/np000257a
Molecular Weight 330.337 g/mol
Solvent CDCl3
Source File Reference UWRU9386