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• W2296133079 abstract "Ultra-high resolution band-selective HSQC (bsHSQC) has been employed for detection of 35 Cl-37 Cl isotope shifted 13 C NMR signals for assignment of regioisomerism in bromo-chloro natural products. Optimum pulse sequence and instrumental parameters for maximization of detection of the isotope shifts were explored. The chlorine isotope shifts (Δδ) were detected within crosspeaks and were shown to vary with hybridization of 13 C, substitution of 13 C, presence of β-chloro substituents, and their relative configuration. Deconvolution of Cl-substituted CH bsHSQC crosspeaks may provide other useful information, including a potentially MS-independent method for quantitating 37 Cl/35 C isotopic fractionation during the biosynthesis of halogenated natural products. Copyright © 2016 John Wiley & Sons, Ltd." @default.
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• W2296133079 date "2016-03-07" @default.
• W2296133079 modified "2023-10-13" @default.
• W2296133079 title "Ultra-high resolution band-selective HSQC for nanomole-scale identification of chlorine-substituted¹³C in natural products drug discovery" @default.
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• W2296133079 doi "https://doi.org/10.1002/mrc.4415" @default.
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