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PETRYNOL
SpectraBase Compound ID 1n4rXLJz3pg
InChI InChI=1S/C13H20O3/c1-3-12(14)10-8-6-4-5-7-9-11-13(15)16-2/h1,8,10,12,14H,4-7,9,11H2,2H3/b10-8+/t12-/m1/s1
InChIKey LQSJBMSGPQIZBT-ZJNQMXKESA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KeqPLXrRPjV
Name PETRYNOL
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-12(14)10-8-6-4-5-7-9-11-13(15)16-2/h1,8,10,12,14H,4-7,9,11H2,2H3/b10-8+/t12-/m1/s1
InChIKey LQSJBMSGPQIZBT-ZJNQMXKESA-N
Literature Reference Author Y.SEO,K.W.CHO,H.S.LEE,J.R.RHO,J.SHIN
Literature Reference Citation J.NAT.PROD.,62,122(1999)
Literature Reference DOI 10.1021/np9803575
Molecular Weight 224.300 g/mol
Solvent CDCl3
Source File Reference UWCS19869