CHEBI:179833 - Etaspirene

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ChEBI Name Etaspirene
ChEBI ID CHEBI:179833
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H22O
Net Charge 0
Average Mass 206.329
Monoisotopic Mass 206.16707
InChI InChI=1S/C14H22O/c1-5-12-7-6-9-13(3,4)14(12)10-8-11(2)15-14/h7-8,10-11H,5-6,9H2,1-4H3
InChIKey NHJSLVJXXDHDRV-UHFFFAOYSA-N
SMILES O1C2(C(CCC=C2CC)(C)C)C=CC1C
ChEBI Ontology
Outgoing Etaspirene (CHEBI:179833) is a dihydrofuran (CHEBI:51659)
IUPAC Name
10-ethyl-2,6,6-trimethyl-1-oxaspiro[4.5]deca-3,9-diene
Manual Xrefs Databases
11227545 ChemSpider
HMDB0036023 HMDB
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Registry Number Type Source
79893-63-3 CAS Registry Number ChemIDplus