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(3R,5S,6S,7E,9R)-5,6-DIHYDRO-5-HYDROXY-3,6-EPOXY-BETA-IONOL
SpectraBase Compound ID v9DHLEkWk3
InChI InChI=1S/C13H22O3/c1-9(14)5-6-13-11(2,3)7-10(16-13)8-12(13,4)15/h5-6,9-10,14-15H,7-8H2,1-4H3/b6-5+/t9-,10+,12-,13-/m0/s1
InChIKey MGKALPYWYBAWNU-RTLCHFMVSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6w3rdGNHuS4
Name (3R,5S,6S,7E,9R)-5,6-DIHYDRO-5-HYDROXY-3,6-EPOXY-BETA-IONOL
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-9(14)5-6-13-11(2,3)7-10(16-13)8-12(13,4)15/h5-6,9-10,14-15H,7-8H2,1-4H3/b6-5+/t9-,10+,12-,13-/m0/s1
InChIKey MGKALPYWYBAWNU-RTLCHFMVSA-N
Literature Reference Author S.NAKAMURA,Y.ZHANG,H.MATSUDA,K.NINOMIYA,O.MURAOKA,M.YOSHIKAW A
Literature Reference Citation CHEM.PHARM.BULL.,59,1020(2011)
Literature Reference DOI 10.1248/cpb.59.1020
Molecular Weight 226.316 g/mol
Source File Reference UWIR3486