(2Z,4'Z)-2-(5-Methylthio-4-penten-2-ynylidene)-1,6-dioxaspiro[4.4]non-3-ene (CHEBI:174196)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(2Z,4'Z)-2-(5-Methylthio-4-penten-2-ynylidene)-1,6-dioxaspiro[4.4]non-3-ene

ChEBI ID	CHEBI:174196

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H14O2S

Net Charge

Average Mass

234.310

Monoisotopic Mass

234.07145

InChI

InChI=1S/C13H14O2S/c1-16-11-4-2-3-6-12-7-9-13(15-12)8-5-10-14-13/h4,6-7,9,11H,5,8,10H2,1H3/b11-4-,12-6+

InChIKey

SOSDBVUESBQTDG-QFQHGIJPSA-N

SMILES

S(/C=C\C#C\C=C/1\OC2(OCCC2)C=C1)C

ChEBI Ontology
Outgoing	(2Z,4'Z)-2-(5-Methylthio-4-penten-2-ynylidene)-1,6-dioxaspiro[4.4]non-3-ene (CHEBI:174196) is a ketal (CHEBI:59777)

IUPAC Name

(2E)-2-[(Z)-5-methylsulanylpent-4-en-2-ynylidene]-1,6-dioxaspiro[4.4]non-3-ene