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5,7-DIBUTANOYLOXY-4-METHYL-2H-1-BENZOPYRAN-2-ONE
SpectraBase Compound ID Fqq8eqibXZg
InChI InChI=1S/C18H20O6/c1-4-6-15(19)22-12-9-13(23-16(20)7-5-2)18-11(3)8-17(21)24-14(18)10-12/h8-10H,4-7H2,1-3H3
InChIKey NSTQZMJZUASRCW-UHFFFAOYSA-N
Mol Weight 332.35 g/mol
Molecular Formula C18H20O6
Exact Mass 332.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CSsiYJofDee
Name 5,7-DIBUTANOYLOXY-4-METHYL-2H-1-BENZOPYRAN-2-ONE
Compound Number 60
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20O6
InChI InChI=1S/C18H20O6/c1-4-6-15(19)22-12-9-13(23-16(20)7-5-2)18-11(3)8-17(21)24-14(18)10-12/h8-10H,4-7H2,1-3H3
InChIKey NSTQZMJZUASRCW-UHFFFAOYSA-N
Literature Reference Author V.S.PARMAR,N.K.SHARMA,M.HUSAIN,A.C.WATTERSON,J.KUMAR,L.A.SAM UELSON,A.L.CHOLLI,A.
Literature Reference Citation BIOORG.MED.CHEM.,11,913(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00539-4
Molecular Weight 332.353 g/mol
Sample ID 38581
Solvent CDCl3