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(2S,4R,5S)-4-hydroxy-5-methoxy-2-[(1R)-1-phenylprop-2-enyl]cyclohexan-1-one
SpectraBase Compound ID DYc5hg94VFH
InChI InChI=1S/C16H20O3/c1-3-12(11-7-5-4-6-8-11)13-9-15(18)16(19-2)10-14(13)17/h3-8,12-13,15-16,18H,1,9-10H2,2H3/t12-,13-,15+,16-/m0/s1
InChIKey XFQZPZFTYDDJIR-UGQVUOCMSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BChtrfvzj6E
Name (2S,4R,5S)-4-hydroxy-5-methoxy-2-[(1R)-1-phenylprop-2-enyl]cyclohexan-1-one
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-3-12(11-7-5-4-6-8-11)13-9-15(18)16(19-2)10-14(13)17/h3-8,12-13,15-16,18H,1,9-10H2,2H3/t12-,13-,15+,16-/m0/s1
InChIKey XFQZPZFTYDDJIR-UGQVUOCMSA-N
Literature Reference Author S.AWALE,S.P.SHRESTHA,Y.TEZUKA,J.Y.UEDA,K.MATSUSHIGE,S.KADOTA
Literature Reference Citation J.NAT.PROD.,68,858(2005)
Literature Reference DOI 10.1021/np050009k
Molecular Weight 260.333 g/mol
Solvent CDCl3
Source File Reference UWMZ10605