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CHEBI:143792 - Captan SO3

ChEBI IDCHEBI:143792
ChEBI NameCaptan SO3
Stars
Last Modified11 June 2019
Submittermwilliams
DownloadsMolfile
FormulaC8H9NO5S
Net Charge0
Average Mass231.229
Monoisotopic Mass231.02014
SMILESO=C1N=C(OS(=O)(=O)O)C2CC=CCC12
InChIInChI=1S/C8H9NO5S/c10-7-5-3-1-2-4-6(5)8(9-7)14-15(11,12)13/h1-2,5-6H,3-4H2,(H,11,12,13)
InChIKeyQTCAUJNUSNHFOR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Captan SO3 (CHEBI:143792) is a isoindoles (CHEBI:24897)
IUPAC Name 
1-oxo-3a,4,7,7a-tetrahydro-1H-isoindol-3-yl hydrogen sulfate
Synonym  Source
(1-oxo-3a,4,7,7a-tetrahydro-1H-isoindol-3-yl)oxidanesulfonic acidChEBI
Citations