CHEBI:179950 - Valeraldehyde propyleneglycol acetal

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ChEBI Name Valeraldehyde propyleneglycol acetal
ChEBI ID CHEBI:179950
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C8H16O2
Net Charge 0
Average Mass 144.214
Monoisotopic Mass 144.11503
InChI InChI=1S/C8H16O2/c1-3-4-5-8-9-6-7(2)10-8/h7-8H,3-6H2,1-2H3
InChIKey WTZJUXYVLRJTMQ-UHFFFAOYSA-N
SMILES O1C(OCC1C)CCCC
ChEBI Ontology
Outgoing Valeraldehyde propyleneglycol acetal (CHEBI:179950) is a dioxolane (CHEBI:39430)
IUPAC Name
2-butyl-4-methyl-1,3-dioxolane
Manual Xrefs Databases
137615 ChemSpider
HMDB0032551 HMDB
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Registry Number Type Source
74094-60-3 CAS Registry Number ChemIDplus