Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01720539
Compound Identification
Common NameAla-Phe-Ala,4TBDMS,isomer#4
Structure
Average Molecular Weight763.4991
SMILESCC(N=C(O[Si](C)(C)C(C)(C)C)C(CC1=CC=CC=C1)N=C(O)C(C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3536.508
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices