Summary of raw spectral data files (and open source equivalents)
ID | Original filename | Data file | Study | Assay | Sample name | tech replicate | Sample collection | Liquid Phase Extraction (LPE) | Solid Phase Extraction (SPE) | SPE frac | Chromatography | Chromatography frac | Measurement | Polarity | Code field |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
11826 | B06_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B06_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B06 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B06_D-DIMS_NEGATIVE |
11827 | B06_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B06_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B06 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B06_D-DIMS_NEGATIVE |
11828 | B07_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B07_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B07_D-DIMS_NEGATIVE |
11829 | B07_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B07_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B07_D-DIMS_NEGATIVE |
11830 | B07_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B07_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B07_D-DIMS_NEGATIVE |
11831 | B07_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B07_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B07_D-DIMS_NEGATIVE |
11832 | B08_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B08_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B08_D-DIMS_NEGATIVE |
11833 | B08_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B08_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B08_D-DIMS_NEGATIVE |
11834 | B08_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B08_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B08_D-DIMS_NEGATIVE |
11835 | B08_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B08_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B08_D-DIMS_NEGATIVE |
11836 | B09_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B09_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B09_D-DIMS_NEGATIVE |
11837 | B09_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B09_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B09_D-DIMS_NEGATIVE |
11838 | B09_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B09_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B09_D-DIMS_NEGATIVE |
11839 | B09_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B09_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B09_D-DIMS_NEGATIVE |
11840 | B10_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B10_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B10_D-DIMS_NEGATIVE |
11841 | B10_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B10_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B10_D-DIMS_NEGATIVE |
11842 | B10_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B10_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B10_D-DIMS_NEGATIVE |
11843 | B10_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B10_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B10_D-DIMS_NEGATIVE |
11844 | B11_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B11_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B11_D-DIMS_NEGATIVE |
11845 | B11_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B11_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B11_D-DIMS_NEGATIVE |
11846 | B11_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B11_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B11_D-DIMS_NEGATIVE |
11847 | B11_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B11_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B11_D-DIMS_NEGATIVE |
11848 | B12_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B12_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B12_D-DIMS_NEGATIVE |
11849 | B12_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | B12_Polar_Blank_WAX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-PHE_B12_D-DIMS_NEGATIVE |
11850 | B12_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | B12_Polar_Daph_WAX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WAX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-PHE_B12_D-DIMS_NEGATIVE |