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CHEBI:174290 - 2-[(5-Methylsulfinyl)-4-penten-2-ynylidene]-1,6-dioxaspiro[4.4]non-3-ene

Default Structure
ChEBI IDCHEBI:174290
ChEBI Name2-[(5-Methylsulfinyl)-4-penten-2-ynylidene]-1,6-dioxaspiro[4.4]non-3-ene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O3S
Net Charge0
Average Mass250.319
Monoisotopic Mass250.06637
SMILESCS(=O)/C=C\C#C/C=C1\C=CC2(CCCO2)O1
InChIInChI=1S/C13H14O3S/c1-17(14)11-4-2-3-6-12-7-9-13(16-12)8-5-10-15-13/h4,6-7,9,11H,5,8,10H2,1H3/b11-4-,12-6+
InChIKeyHGPOBYCDHSNTNP-QFQHGIJPSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(5-Methylsulfinyl)-4-penten-2-ynylidene]-1,6-dioxaspiro[4.4]non-3-ene (CHEBI:174290) is a ketal (CHEBI:59777)
IUPAC Name 
(2E)-2-[(Z)-5-methylsulinylpent-4-en-2-ynylidene]-1,6-dioxaspiro[4.4]non-3-ene
Manual XrefsDatabases
10275814ChemSpider
HMDB0032670HMDB