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. 2017 Mar 8;147(4):549–555. doi: 10.3945/jn.116.243592

TABLE 2.

Parent-daughter ions monitored to determine isotopic enrichments for glutamine and citrulline1

M0, m/z
M+n, m/z
Parent Daughter Parent Daughter Enrichment determined
Glutamine 380 842 381 85 Amino N
380 3633 381 363 Amido N
380 1704 381 170 Whole molecule M+1
380 170 381–3855 170 Carbon skeleton (M+1−M+5)
Citrulline 409 702 410 71 Amino N
409 70 411 72 5,5 2H2
409 3923 410 392 Ureido N
409 392 410 393 Amino N + δ N
409 170 410 170 Whole molecule M+1
409 170 410–4145 170 Carbon skeleton (M+1−M+5)
1

M0, base ion; M+n, isotopologue of interest.

2

Fragments m/z 84 and 70 contain 2-N and 2,3,4 and 5-C of glutamine and citrulline, respectively.

3

Fragments m/z 363 and 392 contain the whole dansylated molecule after the loss of ammonia from the amido or ureido group of glutamine and citrulline, respectively.

4

The fragment m/z 170 represents the dimethyl amino naphthalene fragment of the dansylated molecule.

5

The reporter ion m/z 170 was used to determine the isotope distribution of glutamine and citrulline.