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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 8EULdmeHlNp
Name 5-Butyl-4-(phenylethynyl)furan-2(5H)-one
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.115029753 u
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
Instrument Name JEOL AccuTOF GCx or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201902213
Molecular Weight 240.302 g/mol
Quality 46
Reported Formula C16H16O2
SMILES C(CCC)C1C(=CC(O1)=O)C#CC1=CC=CC=C1
SPLASH splash10-004i-0910000000-a49281726e29ea1aa29f
Source of Spectrum QE-25-SM21-3c (DOI: 10.1002/chem.201902213)
Thin-Layer Chromatography 0.22 (PE/EA, 20:1)
Wiley ID 1893864