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16-ETHOXY-16-OXOHEXADECANE-1,7-DIYL-BIS-(10',16'-DIHYDROXYHEXADECANOATE)

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16-ETHOXY-16-OXOHEXADECANE-1,7-DIYL-BIS-(10',16'-DIHYDROXYHEXADECANOATE)
SpectraBase Compound ID 1diHUjPSiXO
InChI InChI=1S/C50H96O10/c1-2-58-48(55)39-27-12-8-5-11-25-37-47(60-50(57)41-29-14-7-4-10-22-34-46(54)36-24-16-19-31-43-52)38-26-17-20-32-44-59-49(56)40-28-13-6-3-9-21-33-45(53)35-23-15-18-30-42-51/h45-47,51-54H,2-44H2,1H3
InChIKey AIOQSPIJEJPHQI-UHFFFAOYSA-N
Mol Weight 857.3 g/mol
Molecular Formula C50H96O10
Exact Mass 856.700349 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7MXQCyRxJQA
Name 16-ETHOXY-16-OXOHEXADECANE-1,7-DIYL-BIS-(10',16'-DIHYDROXYHEXADECANOATE)
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H96O10
InChI InChI=1S/C50H96O10/c1-2-58-48(55)39-27-12-8-5-11-25-37-47(60-50(57)41-29-14-7-4-10-22-34-46(54)36-24-16-19-31-43-52)38-26-17-20-32-44-59-49(56)40-28-13-6-3-9-21-33-45(53)35-23-15-18-30-42-51/h45-47,51-54H,2-44H2,1H3
InChIKey AIOQSPIJEJPHQI-UHFFFAOYSA-N
Literature Reference Author D.ARRIETA-BAEZ,M.CRUZ-CARRILLO,M.B.GOMEZ-PATINO,L.G.ZEPEDA-V ALLEJO
Literature Reference Citation MOLECULES,16,4923(2011)
Literature Reference DOI 10.3390/molecules16064923
Molecular Weight 857.306 g/mol
Sample ID 307
Solvent CDCl3