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. 2019 Dec 25;25(1):93. doi: 10.3390/molecules25010093

Table 1.

Mass spectrometric analysis parameters of four analytes and IS.

Analyte TR Molecular Formula Ion Mode Theoretical Mass
(m/z)
Measured Mass
(m/z)
Mass Error (ppm)
Butylidenephthalide 8.05 C12H12O2 [M + H]+ 189.09100 189.09105 0.26
Ligustilide 8.38 C12H14O2 [M + H]+ 191.10665 191.10664 0.05
Senkyunolide A 7.86 C12H16O2 [M + H]+ 193.12230 193.12244 0.72
Ferulic acid 3.99 C10H10O4 [M − H] 193.05063 193.04997 3.41
Calycosin-7-O-β-d-glucoside (IS) 4.05 C22H22O10 [M + H]+ 447.12857 447.12817 0.89