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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
11651 | A_P_WAX_4_AMD_NA_LC-MSMS_POS_MJ_REP2_INCL2.raw | A_P_WAX_4_AMD_NA_LC-MSMS_POS_MJ_REP2_INCL2.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMSMS | POSITIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMSMS_POSITIVE |
11652 | A_P_WAX_4_AMD_NA_LC-MSMS_POS_MJ_REP2_INCL2.mzML | A_P_WAX_4_AMD_NA_LC-MSMS_POS_MJ_REP2_INCL2.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMSMS | POSITIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMSMS_POSITIVE |
11653 | 14_R_PolarExtract_Blank_QA_sample_neg_1.raw | 14_R_PolarExtract_Blank_QA_sample_neg_1.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | EQUIL_BLANK | 1 | D-CULT | NA | NA | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | EQUIL_BLANK_D-CULT_NA_NA_0_D-AMD_0_D-LCMS_NEGATIVE |
11654 | 14_R_PolarExtract_Blank_QA_sample_neg_1.mzML | 14_R_PolarExtract_Blank_QA_sample_neg_1.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | EQUIL_BLANK | 1 | D-CULT | NA | NA | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | EQUIL_BLANK_D-CULT_NA_NA_0_D-AMD_0_D-LCMS_NEGATIVE |
11655 | 14_R_PolarExtract_Daphnia_QA_sample_neg_1.raw | 14_R_PolarExtract_Daphnia_QA_sample_neg_1.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | EQUIL | 1 | D-CULT | NA | NA | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | EQUIL_D-CULT_NA_NA_0_D-AMD_0_D-LCMS_NEGATIVE |
11656 | 14_R_PolarExtract_Daphnia_QA_sample_neg_1.mzML | 14_R_PolarExtract_Daphnia_QA_sample_neg_1.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | EQUIL | 1 | D-CULT | NA | NA | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | EQUIL_D-CULT_NA_NA_0_D-AMD_0_D-LCMS_NEGATIVE |
11657 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.raw | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11658 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.mzML | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11659 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.raw | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11660 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.mzML | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11661 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.raw | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11662 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.mzML | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11663 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.raw | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11664 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.mzML | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11665 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP5.raw | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP5.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11666 | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP5.mzML | R_A_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP5.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | DAPH | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | DAPH_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11667 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.raw | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11668 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.mzML | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP1.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11669 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.raw | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11670 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.mzML | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP2.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11671 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.raw | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11672 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.mzML | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP3.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11673 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.raw | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11674 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.mzML | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP4.mzML | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |
11675 | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP5.raw | R_B_P_WAX_4_AMD_NA_LC-MS_NEG_MJ_REP5.raw | DMA of D. magna (2022) | POL_WAX_4_AMD_REPEAT_NEG | BLANK | 1 | D-CULT | D-POL | D-WAX | 4 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WAX_4_D-AMD_0_D-LCMS_NEGATIVE |