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Topic: Polarity (Read 5415 times) previous topic - next topic

Polarity

Hi,

I ran some ESI- data for the first time. I chose negative polarity in the settings, and didn't select any adducts under identification since there were none to choose from.
However, the results table still shows positive isotopes i.e. [3][M+1]+
Is there a mistake?

p.s. job ID is: 3543

I also realized it is very possible I am reading the adducts incorrectly. Can you please explain to me what this means, what it refers to: [3][M+1]+

Thank you.
Majda

Re: Polarity

Reply #1
The way it annotates isotopic peaks has nothing to do with polarity but I can see why the annotation might cause confusion.

[M]+  denotes be the C12 peak, [M+1]+ would be the C13 peak belonging to [M]+ and so on.
is an arbitrary number to indicate features that belong together in that sense, since the order of the features in the table can be changed.

The + simply shows the charge state of the metabolite.
[M+1]+  denotes the C13 peak for a singly charged metabolite.
[M+1]2+  denotes the C13 peak for a doubly charged metabolite.

We should think about modifying this type of annotation for negative mode.

Re: Polarity

Reply #2
Quote from: "majah"
Hi,

However, the results table still shows positive isotopes i.e. [3][M+1]+
Is there a mistake?

Ralf already explained how to read the annotation and I concur that for the negative mode it should be modified, like [3][M+1]-

Quote from: "Ralf"
[M+1]+ denotes the C12 peak for a singly charged metabolite.
Here is a typo, it is the C13 peak.

Re: Polarity

Reply #3
Quote
Here is a typo, it is the C13 peak.

Thanks Carsten, I edited it.

Re: Polarity

Reply #4
Thank you Ralf and Carsten! I get it now.

Majda

Re: Polarity

Reply #5
It is fixed and shows [M]- , [M+1]-, etc. for negative mode now.