Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01713115
Compound Identification
Common Nameindole-3-acetyl-tyrosine,3TBDMS,isomer#1
Structure
Average Molecular Weight679.3788
SMILESCC(C)(C)[Si](C)(C)OC1=CC=C(CC(C(=O)[O-])N(C(=O)CC2=CN([Si](C)(C)C(C)(C)C)C3=CC=CC=C23)[Si](C)(C)C(C)(C)C)C=C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3707.9534
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices