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5-Butyl-4-(phenylethynyl)furan-2(5H)-one

View entire compound with spectra: 2 MS (GC)

5-Butyl-4-(phenylethynyl)furan-2(5H)-one
SpectraBase Compound ID 14HoRxhKayF
InChI InChI=1S/C16H16O2/c1-2-3-9-15-14(12-16(17)18-15)11-10-13-7-5-4-6-8-13/h4-8,12,15H,2-3,9H2,1H3
InChIKey JOUOCOHUKZGUNO-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 J4PP7a5AoxZ
Name 2-butyl-3-(2-phenylethynyl)-2H-furan-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-2-3-9-15-14(12-16(17)18-15)11-10-13-7-5-4-6-8-13/h4-8,12,15H,2-3,9H2,1H3
InChIKey JOUOCOHUKZGUNO-UHFFFAOYSA-N
Molecular Weight 240.302 g/mol
SMILES C(C1=CC(=O)OC1CCCC)#Cc1ccccc1
SPLASH splash10-002f-0790000000-e442208b4d3e449be1a6
Source of Spectrum F-55-12143-3
Wiley ID 839513