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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 17501 | 36_PolarDaphniaExtract_QA_pos_5.raw | 36_PolarDaphniaExtract_QA_pos_5.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17502 | 36_PolarDaphniaExtract_QA_pos_5.mzML | 36_PolarDaphniaExtract_QA_pos_5.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17503 | B_NA_WCX_AMD_NA_LCMS_NEG_1.raw | B_NA_WCX_AMD_NA_LCMS_NEG_1.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17504 | B_NA_WCX_AMD_NA_LCMS_NEG_1.mzML | B_NA_WCX_AMD_NA_LCMS_NEG_1.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17505 | B_NA_WCX_AMD_NA_LCMS_NEG_2.raw | B_NA_WCX_AMD_NA_LCMS_NEG_2.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17506 | B_NA_WCX_AMD_NA_LCMS_NEG_2.mzML | B_NA_WCX_AMD_NA_LCMS_NEG_2.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17507 | B_NA_WCX_AMD_NA_LCMS_NEG_3.raw | B_NA_WCX_AMD_NA_LCMS_NEG_3.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17508 | B_NA_WCX_AMD_NA_LCMS_NEG_3.mzML | B_NA_WCX_AMD_NA_LCMS_NEG_3.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_NEG | BLANK | 1 | D-CULT | D-POL | D-WCX | 0 | D-AMD | 0 | D-LCMS | NEGATIVE | BLANK_D-CULT_D-POL_D-WCX_0_D-AMD_0_D-LCMS_NEGATIVE |
| 17509 | 36_PolarBlankExtract_QA_neg_1.raw | 36_PolarBlankExtract_QA_neg_1.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17510 | 36_PolarBlankExtract_QA_neg_1.mzML | 36_PolarBlankExtract_QA_neg_1.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17511 | 36_PolarBlankExtract_QA_neg_2.raw | 36_PolarBlankExtract_QA_neg_2.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17512 | 36_PolarBlankExtract_QA_neg_2.mzML | 36_PolarBlankExtract_QA_neg_2.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17513 | 36_PolarBlankExtract_QA_pos_1.raw | 36_PolarBlankExtract_QA_pos_1.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17514 | 36_PolarBlankExtract_QA_pos_1.mzML | 36_PolarBlankExtract_QA_pos_1.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17515 | 36_PolarBlankExtract_QA_pos_1_180227215333.raw | 36_PolarBlankExtract_QA_pos_1_180227215333.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17516 | 36_PolarBlankExtract_QA_pos_1_180227215333.mzML | 36_PolarBlankExtract_QA_pos_1_180227215333.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17517 | 36_PolarBlankExtract_QA_pos_2.raw | 36_PolarBlankExtract_QA_pos_2.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17518 | 36_PolarBlankExtract_QA_pos_2.mzML | 36_PolarBlankExtract_QA_pos_2.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL_BLANK | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_BLANK_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17519 | 36_PolarDaphniaExtract_QA_pos_2.raw | 36_PolarDaphniaExtract_QA_pos_2.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17520 | 36_PolarDaphniaExtract_QA_pos_2.mzML | 36_PolarDaphniaExtract_QA_pos_2.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17521 | 36_PolarDaphniaExtract_QA_pos_3.raw | 36_PolarDaphniaExtract_QA_pos_3.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17522 | 36_PolarDaphniaExtract_QA_pos_3.mzML | 36_PolarDaphniaExtract_QA_pos_3.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17523 | 36_PolarDaphniaExtract_QA_pos_4.raw | 36_PolarDaphniaExtract_QA_pos_4.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17524 | 36_PolarDaphniaExtract_QA_pos_4.mzML | 36_PolarDaphniaExtract_QA_pos_4.mzML | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |
| 17525 | 36_PolarDaphniaExtract_QA_pos_6.raw | 36_PolarDaphniaExtract_QA_pos_6.raw | DMA of D. magna (2022) | POL_WCX_NA_AMD_MSM_BLANK_OTHER_POS | EQUIL | 1 | NA | NA | NA | 0 | D-AMD | 0 | D-LCMS | POSITIVE | EQUIL_NA_NA_NA_0_D-AMD_0_D-LCMS_POSITIVE |