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. 2022 Apr 28;10:885977. doi: 10.3389/fbioe.2022.885977

TABLE 4.

Identification of chlorophylls by high resolution high pressure liquid chromatography-mass spectrometry (HPLC-MS) analysis of chlorophyll (Chl) a and b and unknown pigments X1-X4.

Pigment Simulated matching MH+ ion formula Simulated matching MH+ ion [m/z] Actual MH+ ion [m/z] Conformity value [ppm] Potential construct
Chl a C55H73O5N4Mg 893.54259 893.54219 -0.44315 Chlorophyll a
X4 C55H71O5N4Mg 891.52694 891.52644 -0.55846 Chl a + 1 DB
X3 C55H67O5N4Mg 887.49564 887.49532 -0.35664 Chl a + 3 DB
Chl b C55H71O6N4Mg 907.52185 907.52182 -0.04237 Chlorophyll b
X2 C55H69O6N4Mg 905.50620 905.50598 -0.24781 Chl b + 1 DB
X1 C55H65O6N4Mg 901.47490 901.47479 -0.12793 Chl b + 3 DB