Metabolomics Data File Summary
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Summary of raw spectral data files (and open source equivalents)
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Summary
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ID
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Original filename
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Data file
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Study
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Assay
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Sample name
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tech replicate
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Sample collection
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Liquid Phase Extraction (LPE)
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Solid Phase Extraction (SPE)
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SPE frac
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Chromatography
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Chromatography frac
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Measurement
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Polarity
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Code field
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| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 12951 | 19_PolarExtract_Blank_QA_sample_pos_3.raw | 19_PolarExtract_Blank_QA_sample_pos_3.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12952 | 19_PolarExtract_Blank_QA_sample_pos_3.mzML | 19_PolarExtract_Blank_QA_sample_pos_3.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12953 | 19_PolarExtract_Daphnia_QA_sample_pos_1.raw | 19_PolarExtract_Daphnia_QA_sample_pos_1.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12954 | 19_PolarExtract_Daphnia_QA_sample_pos_1.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_1.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12955 | 19_PolarExtract_Daphnia_QA_sample_pos_2.raw | 19_PolarExtract_Daphnia_QA_sample_pos_2.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12956 | 19_PolarExtract_Daphnia_QA_sample_pos_2.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_2.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12957 | 19_PolarExtract_Daphnia_QA_sample_pos_3.raw | 19_PolarExtract_Daphnia_QA_sample_pos_3.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12958 | 19_PolarExtract_Daphnia_QA_sample_pos_3.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_3.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12959 | 19_PolarExtract_Daphnia_QA_sample_pos_4.raw | 19_PolarExtract_Daphnia_QA_sample_pos_4.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12960 | 19_PolarExtract_Daphnia_QA_sample_pos_4.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_4.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12961 | 19_PolarExtract_Daphnia_QA_sample_pos_5.raw | 19_PolarExtract_Daphnia_QA_sample_pos_5.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12962 | 19_PolarExtract_Daphnia_QA_sample_pos_5.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_5.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12963 | 19_PolarExtract_Daphnia_QA_sample_pos_6.raw | 19_PolarExtract_Daphnia_QA_sample_pos_6.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12964 | 19_PolarExtract_Daphnia_QA_sample_pos_6.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_6.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12965 | 19_PolarExtract_Daphnia_QA_sample_pos_7.raw | 19_PolarExtract_Daphnia_QA_sample_pos_7.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12966 | 19_PolarExtract_Daphnia_QA_sample_pos_7.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_7.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12967 | 19_PolarExtract_Daphnia_QA_sample_pos_8.raw | 19_PolarExtract_Daphnia_QA_sample_pos_8.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12968 | 19_PolarExtract_Daphnia_QA_sample_pos_8.mzML | 19_PolarExtract_Daphnia_QA_sample_pos_8.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | EQUIL | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12969 | 19_sleep.raw | 19_sleep.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | MISC | 1 | NA | NA | NA | 0 | D-PHE | 0 | D-LCMS | POSITIVE | MISC_NA_NA_NA_0_D-PHE_0_D-LCMS_POSITIVE |
| 12970 | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP1.raw | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP1.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WCX | 1 | D-AMD | 0 | D-LCMS | POSITIVE | DAPH_D-CULT_D-POL_D-WCX_1_D-AMD_0_D-LCMS_POSITIVE |
| 12971 | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP1.mzML | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP1.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WCX | 1 | D-AMD | 0 | D-LCMS | POSITIVE | DAPH_D-CULT_D-POL_D-WCX_1_D-AMD_0_D-LCMS_POSITIVE |
| 12972 | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP2.raw | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP2.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WCX | 1 | D-AMD | 0 | D-LCMS | POSITIVE | DAPH_D-CULT_D-POL_D-WCX_1_D-AMD_0_D-LCMS_POSITIVE |
| 12973 | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP2.mzML | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP2.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WCX | 1 | D-AMD | 0 | D-LCMS | POSITIVE | DAPH_D-CULT_D-POL_D-WCX_1_D-AMD_0_D-LCMS_POSITIVE |
| 12974 | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP3.raw | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP3.raw | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WCX | 1 | D-AMD | 0 | D-LCMS | POSITIVE | DAPH_D-CULT_D-POL_D-WCX_1_D-AMD_0_D-LCMS_POSITIVE |
| 12975 | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP3.mzML | A_P_WCX_1_AMD_NA_LC-MS_POS_MJ_REP3.mzML | DMA of D. magna (2022) | POL_WCX_1_AMD_POS | DAPH | 1 | D-CULT | D-POL | D-WCX | 1 | D-AMD | 0 | D-LCMS | POSITIVE | DAPH_D-CULT_D-POL_D-WCX_1_D-AMD_0_D-LCMS_POSITIVE |