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Topic: Chemical shift of ATP in P-31 NMR  (Read 4501 times)

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Offline Chan

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Chemical shift of ATP in P-31 NMR
« on: January 24, 2016, 11:39:56 AM »


Can anyone explain the chemical shifts of α,β and γ 13P in adenosine triphosphate (ATP)?
Ignore the phosphocreatine peak.

Offline Irlanur

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Re: Chemical shift of ATP in P-31 NMR
« Reply #1 on: January 24, 2016, 12:29:13 PM »
What would you accept as an explanation? The first and probably most important hint would be that the electron density nearly plays no role at all. The biggest influence comes from "paramagnetic shielding" terms.

Offline Babcock_Hall

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Re: Chemical shift of ATP in P-31 NMR
« Reply #2 on: February 03, 2016, 03:56:45 PM »
One helpful thing to keep in mind with phosphorus NMR is that groups in the gamma position tend to bring about an upfield shift.

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