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. 2023 Jun 11;28(12):4694. doi: 10.3390/molecules28124694

Table 2.

The physicochemical properties and MS/MS conditions of 17 SAs.

Abbreviation Full Name Molecular Weight Log KOW a pKa b Use Retention Time (min) Precursor Ion (m/z) Product Ion
(m/z)
Cone Voltage (V) Collision Energy (eV)
SG sulfaguanidine 214.24 NA NA human 1.03 215 108, 156 * 34 20, 15
SG-D4 218.27 1.03 219 160 * 34 15
SP sulfapyridine 249.29 0.35 2.90, 8.54 human and veterinary 3.12 250 156 *, 184 28 15, 16
SP-13C6 255.24 3.12 256 162 * 28 16
SD sulfadiazine 250.28 −0.09 2.00, 6.48 human and veterinary 2.30 251 92, 156 * 23 27, 15
SD-13C6 256.24 2.30 257 162 * 23 15
ST sulfathiazole 255.32 0.05 2.20, 7.24 human and veterinary 2.81 256 92, 156 * 26 25, 15
ST-D4 259.34 2.76 260 160 * 26 15
SM1 sulfamerazine 264.30 0.14 2.06, 6.90 human and veterinary 3.51 265 92, 156 * 24 25, 15
SM1-13C6 270.26 3.51 271 162 * 24 15
SML sulfamethizole 270.33 0.54 1.86, 5.29 veterinary 5.42 271 92, 156 * 19 30, 15
SML-13C6 276.29 5.42 277 162 * 19 15
SMZ sulfamethoxazole 253.28 0.89 1.85, 5.60 human and veterinary 9.28 254 92, 156 * 27 26, 16
SMZ-13C6 259.23 9.27 260 162 * 27 16
SIZ sulfisoxazole 267.30 1.01 1.66, 4.71 human and veterinary 10.19 268 92, 156 * 22 28, 13
SIZ-13C6 273.26 10.19 274 162 * 22 13
SIM sulfisomidine 278.33 NA NA human 1.96 279 156 *, 186 30 18, 25
SIM-D4 282.31 1.96 283 160 * 30 18
SM2 sulfamethazine 278.33 0.89 2.65, 7.65 human and veterinary 5.19 279.1 92, 186 * 30 28, 16
SM2-D4 282.35 5.11 283.1 186 * 30 16
SMM sulfamonomethoxine 280.30 0.70 1.98, 5.96 human and veterinary 7.73 281 92 *, 156 28 31, 22
SMM-D4 284.33 7.63 285 96 * 28 22
SMP sulfamethoxypyridazine 280.30 0.32 2.09, 6.95 human and veterinary 5.80 281 156 *, 215 34 20, 15
SMP-D3 283.32 5.69 284 156 * 34 20
SM sulfameter 280.30 0.41 1.87, 6.50 human and veterinary 5.24 281 156 *, 215 32 20, 18
SM-D4 284.33 5.16 285 160 * 32 20
SDZ sulfachloropyridazine 284.72 0.31 1.87, 5.45 human and veterinary 7.80 285.1 92, 156 * 22 28, 15
SDZ-13C6 290.68 7.80 291.1 162 * 22 15
SQ sulfaquinoxaline 300.34 1.68 1.86, 5.56 veterinary 11.50 301.1 92.2, 156.1 * 26 30, 16
SQ-13C6 306.29 11.50 307.1 162.1 * 26 16
SDM sulfadoxine 310.33 0.70 1.52, 6.01 human 9.50 311 92, 156 * 20 32, 15
SDM-D3 313.35 9.42 314 156 * 25 20
SPM sulfadimethoxine 310.33 1.63 1.87, 5.86 veterinary 11.40 311.1 92, 156 * 20 32, 21
SPM-D6 316.37 11.33 317.1 162.1 * 25 20

NA: not available; * quantitative ion. a,b The data are from Li et al. [26].