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Re: Pentavalent carbonyl issue (urea formation?) [message #1939 is a reply to message #1938] Fri, 23 June 2023 09:26 Go to previous messageGo to previous message
thomas is currently offline  thomas
Messages: 684
Registered: June 2014
Senior Member
Can you post the reaction as .rxn file, please? Or better a small macro containing the complete combinatorial library task with reaction and one real reactant for each generic reactant? This way I could directly reproduce the issue. Thanks in advance...
 
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