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Methyl 2-(phenylethynyl)cyclopentenylacetate
SpectraBase Compound ID FDNPzJDZh7t
InChI InChI=1S/C16H16O2/c1-18-16(17)12-15-9-5-8-14(15)11-10-13-6-3-2-4-7-13/h2-4,6-7H,5,8-9,12H2,1H3
InChIKey JHJGCOOLMDXJQW-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4n5pPvyyBCI
Name Methyl 2-(phenylethynyl)cyclopentenylacetate
Alternate Name(s) Methyl[2-(phenylethynyl)-1-cyclopenten-1-yl]acetate
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Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-18-16(17)12-15-9-5-8-14(15)11-10-13-6-3-2-4-7-13/h2-4,6-7H,5,8-9,12H2,1H3
InChIKey JHJGCOOLMDXJQW-UHFFFAOYSA-N
Molecular Weight 240.302 g/mol
SMILES C(#Cc1ccccc1)C1=C(CC(=O)OC)CCC1
SPLASH splash10-001l-0940000000-b9e318472a95bbc6373c
Source of Spectrum C-117-10644-28
Wiley ID 759138