CHEBI:179512 - (3R,6S)-3-Hydroxy-1,7-dioxaspiro[5.5]undecane

ChEBI IDCHEBI:179512
ChEBI Name(3R,6S)-3-Hydroxy-1,7-dioxaspiro[5.5]undecane
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SubmitterMetaboLights
DownloadsMolfile
FormulaC9H16O3
Net Charge0
Average Mass172.224
Monoisotopic Mass172.10994
SMILESO[C@@H]1CC[C@]2(CCCCO2)OC1
InChIInChI=1S/C9H16O3/c10-8-3-5-9(12-7-8)4-1-2-6-11-9/h8,10H,1-7H2/t8-,9+/m1/s1
InChIKeyPSXHJXYOZUWYQY-BDAKNGLRSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R,6S)-3-Hydroxy-1,7-dioxaspiro[5.5]undecane (CHEBI:179512) is a ketal (CHEBI:59777)
IUPAC Name 
(3R,6S)-1,7-dioxaspiro[5.5]undecan-3-ol
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LMPK09000005LIPID MAPS
61672247ChemSpider