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. 2020 Jan 21;10:804. doi: 10.1038/s41598-020-57878-y

Table 1.

Optimized MRM transitions of AQC-derivatised chiral amino acids.

Molecular Species Q1 Q3 DP EP CE CXP Time
Lys 487 171 71 10 41 10 100
Orn 473 171 81 10 41 10 100
Trp 375 171 61 10 33 20 100
Tyr 352 171 116 10 31 10 100
Cit 346 171 11 10 37 18 100
Arg 345 171 46 10 41 26 100
Phe 336 171 11 10 29 14 100
His 326 171 36 10 25 22 100
Met 320 171 96 10 29 18 100
Glu 318 171 81 10 29 10 100
Gln 317 171 56 10 35 10 100
Asp 304 171 76 10 29 22 100
Asn 303 171 81 10 25 14 100
Ile 302 171 86 10 27 16 100
allo-Ile 302 171 86 10 27 16 100
Leu 302 171 86 10 27 16 100
Cys 292 171 71 10 27 10 100
Thr 290 171 61 10 27 20 100
allo-Thr 290 171 61 10 27 20 100
Val 288 171 91 10 27 18 100
Pro 286 171 61 10 25 16 100
Ser 276 171 61 10 27 18 100
d4-Ala 264 171 1 10 27 18 100
Ala 260 171 1 10 27 18 100
Gly 246 171 51 10 27 18 100

Multiple Reaction Monitoring: MRM; Q1 Mass: Precursor ion (m/z); Q3 Mass: Product ion (m/z); De-clustering Potential: DP (V); Entrance Potential: EP (V); Collision Energy: CE (V); Collision Cell Exit Potential: CXP (V); Time (msec).