For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
DL-3-O-Allyl-2,6-di-O-benzyl-1-O-(p-methoxybenzyl)-4,5-O-isopropylidene-myo-inositol
SpectraBase Compound ID 8SLkUlkKqac
InChI InChI=1S/C34H40O7/c1-5-20-36-30-28(37-21-24-12-8-6-9-13-24)29(38-23-26-16-18-27(35-4)19-17-26)31(33-32(30)40-34(2,3)41-33)39-22-25-14-10-7-11-15-25/h5-19,28-33H,1,20-23H2,2-4H3/t28-,29+,30-,31-,32+,33+/m1/s1
InChIKey JXUZWRSUOPPMEY-WRPZGQSPSA-N
Mol Weight 560.7 g/mol
Molecular Formula C34H40O7
Exact Mass 560.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9RoRCvIGg48
Name DL-3-O-Allyl-2,6-di-O-benzyl-1-O-(p-methoxybenzyl)-4,5-O-isopropylidene-myo-inositol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H40O7
InChI InChI=1S/C34H40O7/c1-5-20-36-30-28(37-21-24-12-8-6-9-13-24)29(38-23-26-16-18-27(35-4)19-17-26)31(33-32(30)40-34(2,3)41-33)39-22-25-14-10-7-11-15-25/h5-19,28-33H,1,20-23H2,2-4H3/t28-,29+,30-,31-,32+,33+/m1/s1
InChIKey JXUZWRSUOPPMEY-WRPZGQSPSA-N
Molecular Weight 560.687 g/mol
SMILES [C@@]12([C@]([C@](OCC=C)([C@@]([C@@]([C@]2(OCc2ccccc2)[H])(OCc2ccc(cc2)OC)[H])(OCc2ccccc2)[H])[H])(OC(O1)(C)C)[H])[H]
SPLASH splash10-00y0-1501900000-886f7a75d74bdcab2d6f
Source of Spectrum J-62-8339-14
Synonyms (3aS,4R,5S,6S,7R,7aS)-4-(allyloxy)-5,7-bis(benzyloxy)-6-[(4-methoxybenzyl)oxy]-2,2-dimethylhexahydro-1,3-benzodioxole
Wiley ID 1406788