CHEBI:33826 - 1-methoxycyclohexa-1,3-dien-5-yne

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-methoxycyclohexa-1,3-dien-5-yne
ChEBI ID CHEBI:33826
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H6O
Net Charge 0
Average Mass 106.12194
Monoisotopic Mass 106.04186
InChI InChI=1S/C7H6O/c1-8-7-5-3-2-4-6-7/h2-3,5H,1H3
InChIKey WWRBXCYMNIQNBC-UHFFFAOYSA-N
SMILES COC1=CC=CC#C1
ChEBI Ontology
Outgoing 1-methoxycyclohexa-1,3-dien-5-yne (CHEBI:33826) has parent hydride 1,2-didehydrobenzene (CHEBI:33668)
1-methoxycyclohexa-1,3-dien-5-yne (CHEBI:33826) is a benzyne (CHEBI:33667)
IUPAC Name
1-methoxycyclohexa-1,3-dien-5-yne
Registry Number Type Source
4369639 Beilstein Registry Number Beilstein
Last Modified
19 January 2006