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

*Links on SpectraBase are not permalinks.
DL-3-O-Allyl-6-O-benzyl-1-O-(p-methoxybenzyl)-4,5-O-isopropylidene-myo-inositol
SpectraBase Compound ID 6efUeSvOBed
InChI InChI=1S/C27H34O7/c1-5-15-30-23-21(28)22(31-17-19-11-13-20(29-4)14-12-19)24(26-25(23)33-27(2,3)34-26)32-16-18-9-7-6-8-10-18/h5-14,21-26,28H,1,15-17H2,2-4H3/t21-,22+,23-,24-,25+,26+/m1/s1
InChIKey KHYLUSJZDHYIAH-LJXWIPRSSA-N
Mol Weight 470.6 g/mol
Molecular Formula C27H34O7
Exact Mass 470.230453 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 AETA9tez19W
Name DL-3-O-Allyl-6-O-benzyl-1-O-(p-methoxybenzyl)-4,5-O-isopropylidene-myo-inositol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O7
InChI InChI=1S/C27H34O7/c1-5-15-30-23-21(28)22(31-17-19-11-13-20(29-4)14-12-19)24(26-25(23)33-27(2,3)34-26)32-16-18-9-7-6-8-10-18/h5-14,21-26,28H,1,15-17H2,2-4H3/t21-,22+,23-,24-,25+,26+/m1/s1
InChIKey KHYLUSJZDHYIAH-LJXWIPRSSA-N
Molecular Weight 470.562 g/mol
SMILES O[C@@]1([C@@]([C@]([C@]2([C@]([C@@]1(OCC=C)[H])(OC(O2)(C)C)[H])[H])(OCc1ccccc1)[H])(OCc1ccc(cc1)OC)[H])[H]
SPLASH splash10-00fs-1609000000-6b31c6b2a8a807b4c64b
Source of Spectrum J-62-8338-13
Synonyms (3aS,4R,5S,6S,7R,7aS)-4-(allyloxy)-7-(benzyloxy)-6-[(4-methoxybenzyl)oxy]-2,2-dimethylhexahydro-1,3-benzodioxol-5-ol
Wiley ID 1392867