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THIOPALMYRONE
SpectraBase Compound ID LDVOzF11sqg
InChI InChI=1S/C7H10O3S/c1-10-5-2-6(4-8)11-7(9)3-5/h3,6,8H,2,4H2,1H3/t6-/m1/s1
InChIKey LDZGBXIHQQUFKM-ZCFIWIBFSA-N
Mol Weight 174.21 g/mol
Molecular Formula C7H10O3S
Exact Mass 174.035065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fy9vSGiAmA
Name THIOPALMYRONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10O3S
InChI InChI=1S/C7H10O3S/c1-10-5-2-6(4-8)11-7(9)3-5/h3,6,8H,2,4H2,1H3/t6-/m1/s1
InChIKey LDZGBXIHQQUFKM-ZCFIWIBFSA-N
Literature Reference Author A.R.PEREIRA,L.ETZBACH,N.ENGENE,R.MUELLER,W.H.GERWICK
Literature Reference Citation J.NAT.PROD.,74,1175(2011)
Literature Reference DOI 10.1021/np200106b
Molecular Weight 174.215 g/mol
Sample ID 38204
Solvent CDCl3