Showing RIpred-Card for S-Adenosylmethionine,4TMS,isomer#3 (RI00063748)

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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 IDRI00063748
Compound Identification
Common NameS-Adenosylmethionine,4TMS,isomer#3
Structure
Average Molecular Weight687.3026
SMILESC[S+](CC[C@H](N[Si](C)(C)C)C(=O)O[Si](C)(C)C)C[C@H]1O[C@@H](N2C=NC3=C(N[Si](C)(C)C)N=CN=C32)[C@H](O[Si](C)(C)C)[C@@H]1O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4807.6685
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices