Search Results - "de Amorim, Mauro Barbosa"
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Structure reassignment and absolute configuration of 9- epi-presilphiperfolan-1-ol
Published in Tetrahedron letters (14-04-2010)“…Reevaluation of 13C NMR data in combination with X-ray diffraction and VCD studies led us to reassign the structure of (−)- epi-presilphiperfolan-1-ol ( 1),…”
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2
Structural determination of complex natural products by quantum mechanical calculations of 13C NMR chemical shifts: development of a parameterized protocol for terpenes
Published in Journal of molecular modeling (01-08-2016)“…Nuclear magnetic resonance (NMR) spectroscopy is one of the most important tools for determining the structures of organic molecules. Despite the advances made…”
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3
(−)- epi-Presilphiperfolan-1-ol, a new triquinane sesquiterpene from the essential oil of Anemia tomentosa var. anthriscifolia (Pteridophyta)
Published in Tetrahedron letters (19-08-2009)“…The isolation and structure elucidation of (−)- epi-presilphiperfolan-1-ol from the essential oil of Anemia tomentosa var. anthriscifolia are reported. (−)-…”
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4
Structural determination of complex natural products by quantum mechanical calculations of (13)C NMR chemical shifts: development of a parameterized protocol for terpenes
Published in Journal of molecular modeling (01-08-2016)“…Nuclear magnetic resonance (NMR) spectroscopy is one of the most important tools for determining the structures of organic molecules. Despite the advances made…”
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Journal Article -
5
GIAO‐HDFT scaling factor for 13 C NMR chemical shifts calculation
Published in Journal of physical organic chemistry (01-10-2010)“…Abstract In this paper, we present a GIAO‐HDFT scaling factor study, in which we intent to investigate the ability of GIAO‐HDFT/cc‐pVDZ to achieve a high…”
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6
GIAO-HDFT scaling factor for 13C NMR chemical shifts calculation
Published in Journal of physical organic chemistry (01-10-2010)“…In this paper, we present a GIAO‐HDFT scaling factor study, in which we intent to investigate the ability of GIAO‐HDFT/cc‐pVDZ to achieve a high…”
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