Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00060513
Compound Identification
Common NameNicotinic acid mononucleotide,1TMS,isomer#4
Structure
Average Molecular Weight408.0874
SMILESC[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@H]([N+]2=CC=CC(C(=O)O)=C2)[C@H](O)[C@@H]1O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2943.5176
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices