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(Z)-3,6-DIMETHYL-3-(BETA-D-GLUCOSYLMETHYL)-CYCLOHEPT-4-ENONE
SpectraBase Compound ID GZPtu04wOvR
InChI InChI=1S/C16H26O7/c1-9-3-4-16(2,6-10(18)5-9)8-22-15-14(21)13(20)12(19)11(7-17)23-15/h3-4,9,11-15,17,19-21H,5-8H2,1-2H3/t9-,11+,12+,13-,14+,15+,16-/m1/s1
InChIKey XAXCBKBBBHFBEH-YURBCNEZSA-N
Mol Weight 330.38 g/mol
Molecular Formula C16H26O7
Exact Mass 330.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8sVAWQJGk0b
Name (Z)-3,6-DIMETHYL-3-(BETA-D-GLUCOSYLMETHYL)-CYCLOHEPT-4-ENONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26O7
InChI InChI=1S/C16H26O7/c1-9-3-4-16(2,6-10(18)5-9)8-22-15-14(21)13(20)12(19)11(7-17)23-15/h3-4,9,11-15,17,19-21H,5-8H2,1-2H3/t9-,11+,12+,13-,14+,15+,16-/m1/s1
InChIKey XAXCBKBBBHFBEH-YURBCNEZSA-N
Literature Reference Author O.DEMIRKIRAN,G.TOPCU,J.HUSSAIN,V.U.AHMAD,M.I.CHOUDHARY
Literature Reference Citation MAGN.RES.CHEM.,49,673(2011)
Literature Reference DOI 10.1002/mrc.2795
Molecular Weight 330.378 g/mol
Solvent CD3OD
Source File Reference UWBT13006