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CHEBI:51749 - methyl non-2-ynoate

Default Structure
ChEBI IDCHEBI:51749
ChEBI Namemethyl non-2-ynoate
Stars
Last Modified3 February 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC10H16O2
Net Charge0
Average Mass168.236
Monoisotopic Mass168.11503
SMILESCCCCCCC#CC(=O)OC
InChIInChI=1S/C10H16O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-7H2,1-2H3
InChIKeyNTLJTUMJJWVCTL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl non-2-ynoate (CHEBI:51749) is a ynoate ester (CHEBI:51743)
Synonyms  Source
1-Octynecarboxylic acid, methyl esterNIST Chemistry WebBook
2-Nonynoic acid methyl esterChemIDplus
Methyl 2-nonynoateChemIDplus
methyl non-2-ynoateChemIDplus
Methyl octyne carbonateChemIDplus
Methyloctyne carboxylateChemIDplus
Registry NumbersSources
Beilstein:1759870Beilstein
CAS:111-80-8ChemIDplus
CAS:111-80-8NIST Chemistry WebBook