getInchIfromMassBankPeaklist_ChemSpider_workflow_withImage

Created: 2008-06-05 16:00:38      Last updated: 2008-06-16 11:40:46

workflow that queries MassBank DB with peaklist of m/z and intensity values and retrieves SMILES codes for results

after that, it converts these SMILES into ChemSpider's own identifier CSID and queries ChemSpider to get extended compound info according to SMILES/CSID

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