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(4R,5R)-4,5-Bis[benzyloxybis(3-(tetrahydropyran-2-yloxy)prop-1-ynyl)methyl]-2-phenyl-1,3-dioxolane

View entire compound with spectra: 1 MS (GC)

(4R,5R)-4,5-Bis[benzyloxybis(3-(tetrahydropyran-2-yloxy)prop-1-ynyl)methyl]-2-phenyl-1,3-dioxolane
SpectraBase Compound ID DyFBAR98RjS
InChI InChI=1S/C57H66O12/c1-4-22-46(23-5-1)44-66-56(32-18-40-62-49-28-10-14-36-58-49,33-19-41-63-50-29-11-15-37-59-50)53-54(69-55(68-53)48-26-8-3-9-27-48)57(67-45-47-24-6-2-7-25-47,34-20-42-64-51-30-12-16-38-60-51)35-21-43-65-52-31-13-17-39-61-52/h1-9,22-27,49-55H,10-17,28-31,36-45H2/t49?,50?,51?,52?,53-,54-,55?,56?,57?/m1/s1
InChIKey IKSODIOGRRFDCK-COVQUDJFSA-N
Mol Weight 943.1 g/mol
Molecular Formula C57H66O12
Exact Mass 942.455428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jr2x1oYaqFn
Name (4R,5R)-4,5-Bis[benzyloxybis(3-(tetrahydropyran-2-yloxy)prop-1-ynyl)methyl]-2-phenyl-1,3-dioxolane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C57H66O12
InChI InChI=1S/C57H66O12/c1-4-22-46(23-5-1)44-66-56(32-18-40-62-49-28-10-14-36-58-49,33-19-41-63-50-29-11-15-37-59-50)53-54(69-55(68-53)48-26-8-3-9-27-48)57(67-45-47-24-6-2-7-25-47,34-20-42-64-51-30-12-16-38-60-51)35-21-43-65-52-31-13-17-39-61-52/h1-9,22-27,49-55H,10-17,28-31,36-45H2/t49?,50?,51?,52?,53-,54-,55?,56?,57?/m1/s1
InChIKey IKSODIOGRRFDCK-COVQUDJFSA-N
Molecular Weight 943.143 g/mol
SMILES [C@]1([C@@](OC(O1)c1ccccc1)(C(C#CCOC1OCCCC1)(C#CCOC1OCCCC1)OCc1ccccc1)[H])(C(C#CCOC1OCCCC1)(C#CCOC1OCCCC1)OCc1ccccc1)[H]
SPLASH splash10-052x-9200000000-84ee7d2ec08e6261bad0
Source of Spectrum Y2-25-914-8
Synonyms 2-{[4-(benzyloxy)-4-[(4R,5R)-5-[4-(benzyloxy)-1,7-bis(oxan-2-yloxy)hepta-2,5-diyn-4-yl]-2-phenyl-1,3-dioxolan-4-yl]-7-(oxan-2-yloxy)hepta-2,5-diyn-1-yl]oxy}oxane 4,5-Bis[benzyloxybis(3-(tetrahydropyran-2-yloxy)prop-1-ynyl)methyl]-2-phenyl-1,3-dioxolane 4-(5'-{Benzyloxy-5'',3'-[3''-(tetrahydropyran-2''-yloxy)prop-1''-ynyl]methyl-2'-phenyl-1',3'-dioxolan-4'-yl)-1,7-bis(tetrahydropyran-2'-yloxy)hepta-4-(benzyloxy)-2,5-diyne-4 4-(5'-{Benzyloxy-5'',3'-[3''-(tetrahydropyran-2''-yloxy)prop-1''-ynyl]methyl-2'-phenyl-1',3'-dioxolan-4'-yl)-1,7-bis(tetrahydropyran-2'-yloxy)hepta-4-(benzyloxy)-2,5-diyne-4 4-(5'-{Ethoxy-5'',3''-[3'''-(tetrahydropyran-2'''-yloxy)prop-1''-ynyl]methyl}-2'-phenyl-1',3'-dioxolan-4'-yl)-1,7-bis(tetrahydropyran-2-yloxy)-4-ethoxyhepta-2,5-diyne 4-(5'-{Ethoxy-5'',3''-[3'''-(tetrahydropyran-2'''-yloxy)prop-1''-ynyl]methyl}-2'-phenyl-1',3'-dioxolan-4'-yl)-1,7-bis(tetrahydropyran-2-yloxy)-4-ethoxyhepta-2,5-diyne
Wiley ID 1547170