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MB Sample ID: SA194077
| Local Sample ID: | 73098_6 |
| Subject ID: | SU002144 |
| Subject Type: | Plant |
| Subject Species: | Lithospermum officinale |
| Taxonomy ID: | 475907 |
Select appropriate tab below to view additional metadata details:
Combined analysis:
| Analysis ID | AN003361 |
|---|---|
| Analysis type | MS |
| Chromatography type | Reversed phase |
| Chromatography system | Thermo Vanquish |
| Column | Waters Acquity UPLC HSS C18 SB (100 x 2.1mm, 1.8um) |
| MS Type | ESI |
| MS instrument type | Orbitrap |
| MS instrument name | Thermo Q Exactive Focus |
| Ion Mode | POSITIVE |
| Units | intensity units |
MS:
| MS ID: | MS003130 |
| Analysis ID: | AN003361 |
| Instrument Name: | Thermo Q Exactive Focus |
| Instrument Type: | Orbitrap |
| MS Type: | ESI |
| MS Comments: | The solvents used were ultrapure water (A) and methanol (B), both with 0.1% (v/v) formic acid. The gradient elution program was as follows: 0 min 95A/5B, 1 min 50A/50B, 8 min 0A/100B, 13 min 0A/100B, 13.01 min 95A/5B, 16 min 95A/5B. Data were acquired in positive ionisation mode, with the capillary temperature set to 320 oC using the instrument's MS/MS discovery feature. The normalised collision energy was set to 35 eV. The instrument control, acquisition and initial processing of the data were conducted by the Xcalibur software (version 4.1, Thermo Scientific, USA). Furthermore, data alignment and feature extraction were performed on the XCMS online platform (Huan et al., 2017). Identification of some detected compounds was performed using the software Compound Discoverer (version 3.2, Thermo Scientific, USA). |
| Ion Mode: | POSITIVE |
