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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
16543 | B06_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B06_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B06 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B06_D-DIMS_NEGATIVE |
16544 | B07_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B07_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B07_D-DIMS_NEGATIVE |
16545 | B07_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B07_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B07_D-DIMS_NEGATIVE |
16546 | B07_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B07_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B07_D-DIMS_NEGATIVE |
16547 | B07_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B07_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B07 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B07_D-DIMS_NEGATIVE |
16548 | B08_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B08_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B08_D-DIMS_NEGATIVE |
16549 | B08_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B08_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B08_D-DIMS_NEGATIVE |
16550 | B08_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B08_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B08_D-DIMS_NEGATIVE |
16551 | B08_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B08_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B08 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B08_D-DIMS_NEGATIVE |
16552 | B09_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B09_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B09_D-DIMS_NEGATIVE |
16553 | B09_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B09_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B09_D-DIMS_NEGATIVE |
16554 | B09_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B09_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B09_D-DIMS_NEGATIVE |
16555 | B09_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B09_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B09 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B09_D-DIMS_NEGATIVE |
16556 | B10_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B10_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B10_D-DIMS_NEGATIVE |
16557 | B10_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B10_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B10_D-DIMS_NEGATIVE |
16558 | B10_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B10_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B10_D-DIMS_NEGATIVE |
16559 | B10_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B10_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B10 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B10_D-DIMS_NEGATIVE |
16560 | B11_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B11_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B11_D-DIMS_NEGATIVE |
16561 | B11_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B11_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B11_D-DIMS_NEGATIVE |
16562 | B11_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B11_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B11_D-DIMS_NEGATIVE |
16563 | B11_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B11_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B11 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B11_D-DIMS_NEGATIVE |
16564 | B12_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B12_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B12_D-DIMS_NEGATIVE |
16565 | B12_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B12_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B12_D-DIMS_NEGATIVE |
16566 | B12_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B12_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B12_D-DIMS_NEGATIVE |
16567 | B12_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B12_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | DMA of D. magna (2022) | POL_WCX_4_PHE_NEG | DAPH | 1 | D-CULT | D-POL | D-WCX | 4 | D-PHE | B12 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B12_D-DIMS_NEGATIVE |