Showing RIpred-Card for Thujan-3-ol,3TBDMS,isomer#1 (RI01716639)

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IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01716639
Compound Identification
Common NameThujan-3-ol,3TBDMS,isomer#1
Structure
Average Molecular Weight682.318
SMILESCC(=N[C@H](CSC(=NCCCC[S@](C)=O)S[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3888.297
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices