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(2R,3S,4S,5R,6S,7R)-1-Benzoyloxy-7-(4-methoxybenzyloxy)-5,6-[1-(4-methoxyphenyl)ethylidenedioxy]-2,4,6-trimethylnonan-3-ol

View entire compound with spectra: 1 MS (GC)

(2R,3S,4S,5R,6S,7R)-1-Benzoyloxy-7-(4-methoxybenzyloxy)-5,6-[1-(4-methoxyphenyl)ethylidenedioxy]-2,4,6-trimethylnonan-3-ol
SpectraBase Compound ID KL0F8HwhVmK
InChI InChI=1S/C36H46O8/c1-8-31(41-23-26-14-18-29(39-6)19-15-26)35(4)33(43-36(5,44-35)28-16-20-30(40-7)21-17-28)25(3)32(37)24(2)22-42-34(38)27-12-10-9-11-13-27/h9-21,24-25,31-33,37H,8,22-23H2,1-7H3/t24-,25+,31-,32+,33-,35+,36?/m1/s1
InChIKey JTMOHTBKOQYIAS-CWSBLCLASA-N
Mol Weight 606.8 g/mol
Molecular Formula C36H46O8
Exact Mass 606.319268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53iPxs7IDIn
Name (2R,3S,4S,5R,6S,7R)-1-Benzoyloxy-7-(4-methoxybenzyloxy)-5,6-[1-(4-methoxyphenyl)ethylidenedioxy]-2,4,6-trimethylnonan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H46O8
InChI InChI=1S/C36H46O8/c1-8-31(41-23-26-14-18-29(39-6)19-15-26)35(4)33(43-36(5,44-35)28-16-20-30(40-7)21-17-28)25(3)32(37)24(2)22-42-34(38)27-12-10-9-11-13-27/h9-21,24-25,31-33,37H,8,22-23H2,1-7H3/t24-,25+,31-,32+,33-,35+,36?/m1/s1
InChIKey JTMOHTBKOQYIAS-CWSBLCLASA-N
Molecular Weight 606.756 g/mol
SMILES O[C@]([C@@]([C@@]1([C@@](OC(c2ccc(cc2)OC)(C)O1)([C@](OCc1ccc(OC)cc1)(CC)[H])C)[H])(C)[H])([C@@](COC(=O)c1ccccc1)(C)[H])[H]
SPLASH splash10-00di-0920000000-03d047169c2a5822a08f
Source of Spectrum E1-37-1163-22
Synonyms (2R,3S,4S,5R,6R,7R)-1-Benzoyloxy-7-(4-methoxybenzyloxy)-5,6-[1-(4-methoxyphenyl)ethylidenedioxy]-2,4,6-trimethylnonan-3-ol 1-O-benzoyl-2,4,8,9-tetradeoxy-7-O-(4-methoxybenzyl)-5,6-O-[1-(4-methoxyphenyl)ethylidene]-2,4-dimethyl-6-C-methyl-D-threo-L-galacto-nonitol
Wiley ID 1517704