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SCABROL_A;(4-R,5-S,8-R,9-R)-8-HYDROXY-4,8-DIMETHYLHEXAHYDROCYCLOPENTA-[C]-PYRAN-3-(1-H)-ONE
SpectraBase Compound ID 3ULb5u1b38n
InChI InChI=1S/C10H16O3/c1-6-7-3-4-10(2,12)8(7)5-13-9(6)11/h6-8,12H,3-5H2,1-2H3/t6-,7-,8+,10-/m1/s1
InChIKey KCIYXMDQXNFJBA-BDNRQGISSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B4neBoiGTJ6
Name SCABROL_A;(4-R,5-S,8-R,9-R)-8-HYDROXY-4,8-DIMETHYLHEXAHYDROCYCLOPENTA-[C]-PYRAN-3-(1-H)-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-6-7-3-4-10(2,12)8(7)5-13-9(6)11/h6-8,12H,3-5H2,1-2H3/t6-,7-,8+,10-/m1/s1
InChIKey KCIYXMDQXNFJBA-BDNRQGISSA-N
Literature Reference Author N.LI,L.DI,W.C.GAO,K.J.WANG,L.B.ZU
Literature Reference Citation J.NAT.PROD.,75,1723(2012)
Literature Reference DOI 10.1021/np300286t
Molecular Weight 184.235 g/mol
Sample ID 41508
Solvent CDCl3