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PESTALOTHEOL_C

View entire compound with spectra: 1 NMR

PESTALOTHEOL_C
SpectraBase Compound ID EIC9jiJJcQr
InChI InChI=1S/C16H24O4/c1-9(2)5-6-10-7-11-16(14(20-16)13(10)17)8-12(19-11)15(3,4)18/h5-6,11-14,17-18H,7-8H2,1-4H3/b10-6+/t11-,12+,13+,14-,16+/m0/s1
InChIKey FWSQMPDAXKALDF-IOMCIBOKSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bm4M6mImkAw
Name PESTALOTHEOL_C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-9(2)5-6-10-7-11-16(14(20-16)13(10)17)8-12(19-11)15(3,4)18/h5-6,11-14,17-18H,7-8H2,1-4H3/b10-6+/t11-,12+,13+,14-,16+/m0/s1
InChIKey FWSQMPDAXKALDF-IOMCIBOKSA-N
Literature Reference Author E.LI,R.TIAN,S.LIU,X.CHEN,L.GUO,Y.CHE
Literature Reference Citation J.NAT.PROD.,71,664(2008)
Literature Reference DOI 10.1021/np700744t
Molecular Weight 280.364 g/mol
Sample ID 27677
Solvent ACETONE-D6