Toward the Complete Prediction of the1H and13C NMR Spectra of Complex Organic Molecules by DFT Methods: Application to Natural Substances
Author:
Publisher
Wiley
Subject
General Chemistry,Catalysis,Organic Chemistry
Reference68 articles.
1. Die Jagd auf Moleküle, die nie existiert haben: Falsch zugeordnete Naturstoffstrukturen und die Rolle der chemischen Synthese in der modernen Strukturaufklärung
2. Chasing Molecules That Were Never There: Misassigned Natural Products and the Role of Chemical Synthesis in Modern Structure Elucidation
3. ?-Pinene and myrtenol: complete1H NMR assignment
4. 13C NMR spectroscopy of monoterpenoids
5. Computer-Assisted Constitutional Assignment of Large Molecules: Cocon Analysis of Ascomycin
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