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Topic: H-NMR question  (Read 4168 times)

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Offline chalconix

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H-NMR question
« on: July 30, 2009, 05:59:42 PM »
Hello there! I read the forum topics for months now but never posted before!

I wanted to ask a question for H-NMR.

I have a spectrum including 2 AB aromatic protons that appear as distorted triplet. How can i write this down when i do the assignment? I thought to write it down as (dd,2H) but i don't know if this is the right way.

Thanks in advance...

 :)

Offline alphahydroxy

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Re: H-NMR question
« Reply #1 on: August 04, 2009, 12:27:52 PM »

I think your description is fine - it is what I would do I reckon.



Offline frenchy

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Re: H-NMR question
« Reply #2 on: August 08, 2009, 08:35:59 AM »
if you quote as a dd, or triplet, you're expected to quote the J value as well. It's worthwhile in this case to quote it as a multiplet.
PhD student in synthetic Inorganic and Supramolecular chemistry.

Offline chalconix

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Re: H-NMR question
« Reply #3 on: August 15, 2009, 03:57:04 PM »
Thanks for your replies!

@frenchy
Generally (and also in cases like this at all of my compounds) i calculated the J where it was possible to calculate it. When there was no strange "mixing" of doublets etc... They are all novel compounds which i synthesized so i did what i could.. I also have in the molecule trans protons at a double bond, for which it was NOT possible in 100% of the spectra to calculate the J of BOTH of the alkene protons (generally calculated as J=15.6 Hz).

Offline frenchy

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Re: H-NMR question
« Reply #4 on: August 19, 2009, 05:42:01 AM »
if you download the free version of MestRe Nova, you should be able to just measure it instead of having to calculate it. that is if your spectra are electronic
PhD student in synthetic Inorganic and Supramolecular chemistry.

Offline chalconix

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Re: H-NMR question
« Reply #5 on: August 19, 2009, 10:40:31 AM »
It is not accurate.. very small changes at where you point your mouse make 0.3-0.6 hz difference. On the contrary, the peak in ppm is always one number :)

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