CHEBI:173950 - 5-Hydroxy-2-benzyl-1,3-dioxane

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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 5-Hydroxy-2-benzyl-1,3-dioxane
ChEBI ID CHEBI:173950
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H14O3
Net Charge 0
Average Mass 194.230
Monoisotopic Mass 194.09429
InChI InChI=1S/C11H14O3/c12-10-7-13-11(14-8-10)6-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2
InChIKey SCBQUBIXYNMXER-UHFFFAOYSA-N
SMILES O1C(OCC(O)C1)CC2=CC=CC=C2
ChEBI Ontology
Outgoing 5-Hydroxy-2-benzyl-1,3-dioxane (CHEBI:173950) is a dioxanes (CHEBI:46926)
IUPAC Name
2-benzyl-1,3-dioxan-5-ol
Manual Xrefs Databases
70841 ChemSpider
HMDB0041505 HMDB
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