3-Hydroxypropyl-Glucosinolate; LC-ESI-ITFT; MS2; HCD; CE 35.0 eV; [M-H]-
Chemical Info
Synonyms |
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3-Hydroxypropyl-Glucosinolate |
InChI | InChI=1S/C10H19NO10S2/c12-3-1-2-6(11-21-23(17,18)19)22-10-9(16)8(15)7(14)5(4-13)20-10/h5,7-10,12-16H,1-4H2,(H,17,18,19)/b11-6+ |
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SMILES | [H]OC([H])([H])C([H])([H])C([H])([H])C(=NOS(O)(=O)=O)SC([H])(O1)C([H])(O)C([H])(O[H])C([H])(O[H])C([H])(CO)1 |
InChI Key | WIGYSAIZPJAWDF-IZZDOVSWSA-N |
Molecular Formula | C10H19NO10S2 |
Exact Mass | 377.046 g/mol |
Data and Resources
Additional Info
Field | Value |
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Source | https://massbank.eu/MassBank/RecordDisplay?id=CE000516 |
Last Updated | May 11, 2022, 19:46 (UTC) |
Created | May 11, 2022, 19:46 (UTC) |
dateCreated | 2012-04-12T00:00:00 |
datePublished | 2016-01-19T00:00:00 |
harvest_object_id | ccec5dd9-3228-470b-8cf5-47d81a260b02 |
harvest_source_id | 3bad9e9a-f7d3-4dd2-8fd5-0080dbfd0fea |
harvest_source_title | Bioschema MassBank |