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. 2018 Oct 1;8:14587. doi: 10.1038/s41598-018-32501-3

Table 2.

Multiple reaction monitoring (MRM) parameters of GAA, HA and IAA.

Parameters GAA HA IAA SB
Precursor Ion (m/z) 118.1 180.1 176.1 232
Fragmentor (V) 90 60 91 90
Quantifier transition production (m/z) with CE (V) 76
(12)
105
(12)
130.1
(16)
187.9
(10)
Qualifier transition production (m/z) with CE (V) 101
(8)
77
(36)
103.1
(36)
140
(10)
CAV (V) 4 4 4 4
Dwell time (ms) 30 30 30 30
Polarity (+) (+) (+) (−)

Guanidinoacetic acid (GAA); hippuric acid (HA); indoleacetic acid (IAA); sulbactam (SB); cell accelerator voltage (CAV); collision energy (CE).

For mass spectrometry, dry gas temperature, dry gas flow, nebulizer, sheath gas temperature, sheath gas flow, capillary voltage, EMV voltage and nozzle voltage were set at 300 °C, 5 L/min, 35 psi, 250 °C, 11 L/min, 4000 V for positive and −3500 V for negative mode, 250 V (both positive and negative mode) and 500 V, respectively.