Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01703277
Compound Identification
Common NamePelargonidin 3-O-[b-D-Xylopyranosyl-(1->2)-a-D-glucopyranoside],2TMS,isomer#33
Structure
Average Molecular Weight709.2342
SMILESC[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC=C(O)C=C2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O[Si](C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index7055.4146
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices