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SINULARONE-H
SpectraBase Compound ID 87UAU10UEg
InChI InChI=1S/C12H18O5/c1-5-16-12(7-6-10(13)15-4)9(3)8(2)11(14)17-12/h5-7H2,1-4H3/t12-/m0/s1
InChIKey KZMWIKBWSRVQNN-LBPRGKRZSA-N
Mol Weight 242.27 g/mol
Molecular Formula C12H18O5
Exact Mass 242.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 32xKiePrj0M
Name SINULARONE-H
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O5
InChI InChI=1S/C12H18O5/c1-5-16-12(7-6-10(13)15-4)9(3)8(2)11(14)17-12/h5-7H2,1-4H3/t12-/m0/s1
InChIKey KZMWIKBWSRVQNN-LBPRGKRZSA-N
Literature Reference Author H.SHI,S.YU,D.LIU,L.V.OFWEGEN,P.PROKSCH,W.LIN
Literature Reference Citation MAR.DRUGS,10,1331(2012)
Literature Reference DOI 10.3390/md10061331
Molecular Weight 242.272 g/mol
Source File Reference UWIR5846