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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
16518 | A12_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | A12_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 | A12 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_A12_D-DIMS_NEGATIVE |
16519 | A12_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | A12_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 | A12 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_A12_D-DIMS_NEGATIVE |
16520 | A12_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | A12_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 | A12 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_A12_D-DIMS_NEGATIVE |
16521 | B01_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B01_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 | B01 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B01_D-DIMS_NEGATIVE |
16522 | B01_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B01_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 | B01 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B01_D-DIMS_NEGATIVE |
16523 | B01_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B01_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 | B01 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B01_D-DIMS_NEGATIVE |
16524 | B01_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B01_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 | B01 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B01_D-DIMS_NEGATIVE |
16525 | B02_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B02_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 | B02 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B02_D-DIMS_NEGATIVE |
16526 | B02_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B02_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 | B02 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B02_D-DIMS_NEGATIVE |
16527 | B02_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B02_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 | B02 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B02_D-DIMS_NEGATIVE |
16528 | B02_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B02_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 | B02 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B02_D-DIMS_NEGATIVE |
16529 | B03_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B03_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 | B03 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B03_D-DIMS_NEGATIVE |
16530 | B03_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B03_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 | B03 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B03_D-DIMS_NEGATIVE |
16531 | B03_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B03_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 | B03 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B03_D-DIMS_NEGATIVE |
16532 | B03_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B03_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 | B03 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B03_D-DIMS_NEGATIVE |
16533 | B04_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B04_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 | B04 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B04_D-DIMS_NEGATIVE |
16534 | B04_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B04_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 | B04 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B04_D-DIMS_NEGATIVE |
16535 | B04_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B04_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 | B04 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B04_D-DIMS_NEGATIVE |
16536 | B05_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B05_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 | B05 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B05_D-DIMS_NEGATIVE |
16537 | B05_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B05_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 | B05 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B05_D-DIMS_NEGATIVE |
16538 | B05_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B05_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 | B05 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B05_D-DIMS_NEGATIVE |
16539 | B05_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B05_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 | B05 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B05_D-DIMS_NEGATIVE |
16540 | B06_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B06_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 | B06 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B06_D-DIMS_NEGATIVE |
16541 | B06_Polar_Blank_WCX4_Phenyl_LCMS_Neg_DIMS.mzML | B06_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 | B06 | D-DIMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_4_D-PHE_B06_D-DIMS_NEGATIVE |
16542 | B06_Polar_Daph_WCX4_Phenyl_LCMS_Neg_DIMS.raw | B06_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 | B06 | D-DIMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WCX_4_D-PHE_B06_D-DIMS_NEGATIVE |