SpectraBase Spectrum ID |
4F7e0MIJn6H |
Name |
Methyl-3,4-di-o-methyl-2-o-(2,3,4-tri-o-methyl.alpha.L-rhamnopyranosyl).alpha.L-rhamnopyranoside |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
394.220282666 u |
Formula |
C18H34O9 |
InChI |
InChI=1S/C18H34O9/c1-9-12(20-4)14(22-6)16(17(24-8)25-9)27-18-15(23-7)13(21-5)11(19-3)10(2)26-18/h9-18H,1-8H3/t9-,10-,11-,12-,13+,14+,15+,16+,17+,18-/m0/s1 |
InChIKey |
XHVAYVKHJBKFSN-AYRBRSHGSA-N |
Molecular Weight |
394.461 g/mol |
SMILES |
[C@@]1([C@@](OC)([C@@](OC)([C@@](O[C@]1(C)[H])(O[C@@]1([C@@]([C@]([C@@](O[C@]1(OC)[H])(C)[H])(OC)[H])(OC)[H])[H])[H])[H])[H])(OC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910851 |