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

*Links on SpectraBase are not permalinks.
Methyl 2-[(3aS*,4R*,5S*,6R*,6aR*)-5,6-di(benzyloxymethyl)2,2-dimethylperhydrocyclopenta[d][1,3]dioxol-4-yl]acetate
SpectraBase Compound ID 7FURb56k2N2
InChI InChI=1S/C27H34O6/c1-27(2)32-25-21(14-24(28)29-3)22(17-30-15-19-10-6-4-7-11-19)23(26(25)33-27)18-31-16-20-12-8-5-9-13-20/h4-13,21-23,25-26H,14-18H2,1-3H3/t21-,22+,23+,25+,26-/m1/s1
InChIKey SZHUFHAZDBUMRE-AOGDTGQESA-N
Mol Weight 454.6 g/mol
Molecular Formula C27H34O6
Exact Mass 454.235539 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 LYozu3xxLpt
Name Methyl 2-[(3aS*,4R*,5S*,6R*,6aR*)-5,6-di(benzyloxymethyl)2,2-dimethylperhydrocyclopenta[d][1,3]dioxol-4-yl]acetate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O6
InChI InChI=1S/C27H34O6/c1-27(2)32-25-21(14-24(28)29-3)22(17-30-15-19-10-6-4-7-11-19)23(26(25)33-27)18-31-16-20-12-8-5-9-13-20/h4-13,21-23,25-26H,14-18H2,1-3H3/t21-,22+,23+,25+,26-/m1/s1
InChIKey SZHUFHAZDBUMRE-AOGDTGQESA-N
Molecular Weight 454.563 g/mol
SMILES [C@]12([C@@]([C@@](COCc3ccccc3)([C@]([C@]1(CC(=O)OC)[H])(COCc1ccccc1)[H])[H])(OC(O2)(C)C)[H])[H]
SPLASH splash10-0006-9000000000-a6a1bfd9a4c11cede7f7
Source of Spectrum QA-46-938-11
Synonyms methyl {(3aS,4R,5S,6R,6aR)-5,6-bis[(benzyloxy)methyl]-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl}acetate
Wiley ID 863199