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AMPELOMIN_E;(1-S*,2-R*,4-S*,5-S*)-5-METHYLCYCLOHEXANE-1,2,4-TRIOL
SpectraBase Compound ID COmSDokuDHZ
InChI InChI=1S/C7H14O3/c1-4-2-6(9)7(10)3-5(4)8/h4-10H,2-3H2,1H3/t4-,5-,6-,7+/m0/s1
InChIKey DKCGTIMNFPMKNS-ZTYPAOSTSA-N
Mol Weight 146.19 g/mol
Molecular Formula C7H14O3
Exact Mass 146.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ib1kYEKoq5B
Name AMPELOMIN_E;(1-S*,2-R*,4-S*,5-S*)-5-METHYLCYCLOHEXANE-1,2,4-TRIOL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14O3
InChI InChI=1S/C7H14O3/c1-4-2-6(9)7(10)3-5(4)8/h4-10H,2-3H2,1H3/t4-,5-,6-,7+/m0/s1
InChIKey DKCGTIMNFPMKNS-ZTYPAOSTSA-N
Literature Reference Author H.ZHANG,J.XUE,P.WU,L.XU,H.XIE,X.WEI
Literature Reference Citation J.NAT.PROD.,72,265(2009)
Literature Reference DOI 10.1021/np800667e
Molecular Weight 146.186 g/mol
Sample ID 32194
Solvent C5D5N