Hydrogen bonding causes distinct downfield shifts in nuclear magnetic resonance spectra
Is it true that hydrogen bonding causes distinct downfield shifts in nuclear magnetic resonance spectra?
Yes. Hydrogen bonding typically causes distinct downfield chemical shifts (deshielding) in nuclear magnetic resonance spectra, a foundational principle widely supported by spectroscopic and computational analyses.
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The retrieved literature discusses how hydrogen bonding interactions directly influence nuclear magnetic resonance (NMR) parameters, specifically noting the traditional and well-documented occurrence of downfield chemical shifts (deshielding) upon hydrogen bond formation (e.g., in papers [3], [5], and [9]). While paper [3] notes rare exceptions involving blue-shifting hydrogen bonds that display shielding, the overwhelming spectroscopic consensus and baseline principle confirmed across the evidence is that hydrogen bonding correlates with downfield shifts.
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Manna, D., Lo, R., Lamanec, M., Pavlišová, J., Socha, O., Dračínský, M., & Hobza, P. (2025). Beyond Deshielding: NMR Evidence of Shielding in Hydridic and Protonic Hydrogen Bonds. doi.org. https://doi.org/10.1021/acs.jctc.5c00870
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M, E. B., EH, E., & MM, E. (2026). Donor-acceptor dichotomy in novel Schiff bases: comprehensive spectroscopic and DFT investigation of intramolecular hydrogen bonding and charge-transfer properties.. doi.org. https://doi.org/10.1039/d6ra01520d
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Kostin, M. A., Alkhuder, O., Asfin, R., & Tolstoy, P. (2024). Twin hydrogen bonds with phosphine oxide: anticooperativity effects caused by competing proton donors.. doi.org. https://doi.org/10.1039/d4cp04041d
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