annotate test-data/outTab_test03.tabular @ 1:2744d20c830a draft default tip

" master branch Updating with tag :CI_COMMIT_TAG - - Fxx"
author fgiacomoni
date Fri, 27 Nov 2020 11:21:58 +0000
parents de13e2c45971
children
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1 _MESURED_MONOISOTOPIC_MASS_ _PPM_ERROR_ _COMPUTED_MONOISOTOPIC_MASS_ _ANNOTATION_NAME_ _ANNOTATION_TYPE_ _ANNOTATION_IN_NEG_MODE_ _ANNOTATION_IN_POS_MODE_ _ANNOTATION_FORMULA_
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2 44.9981010714674 2.3 44.9982036 "Formic acid" unknown [M-H]- NA NA
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3 44.9981024029652 2.2 44.9982036 "Formic acid" unknown [M-H]- NA NA
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4 44.998112256197 2.0 44.9982036 "Formic acid" unknown [M-H]- NA NA
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6 59.0137157156687 2.3 59.0138536 "Acetic Acid" Solvent [M-H]- NA NA
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7 59.0137129234658 2.4 59.0138536 "Acetic Acid" Solvent [M-H]- NA NA
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16 78.9589162539509 1.8 78.9590566 "Phosphoric acid" unknown [M-H3O]- NA NA
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17 79.9572959941509 0.9 79.9573656 "Sulphuric acid" unknown [M-H2O]- NA NA
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18 79.9572310694573 1.7 79.9573656 "Sulphuric acid" unknown [M-H2O]- NA NA
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19 79.9572880455522 1.0 79.9573656 "Sulphuric acid" unknown [M-H2O]- NA NA
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39 94.9807499641041 1.0 94.9808406 Methanesulfonate unknown [M-H]- NA NA
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