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5-Isopropyl-4-(phenylethynyl)furan-2(5H)-one
SpectraBase Compound ID BdSPyx1VGuF
InChI InChI=1S/C15H14O2/c1-11(2)15-13(10-14(16)17-15)9-8-12-6-4-3-5-7-12/h3-7,10-11,15H,1-2H3
InChIKey YYKCADFCJZUVPV-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C15H14O2
Exact Mass 226.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VgsHX7NEWm
Name 5-Isopropyl-4-(phenylethynyl)furan-2(5H)-one
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.099379689 u
Formula C15H14O2
InChI InChI=1S/C15H14O2/c1-11(2)15-13(10-14(16)17-15)9-8-12-6-4-3-5-7-12/h3-7,10-11,15H,1-2H3
InChIKey YYKCADFCJZUVPV-UHFFFAOYSA-N
Instrument Name JEOL AccuTOF GCx or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201902213
Molecular Weight 226.275 g/mol
Quality 57
Reported Formula C15H14O2
SMILES C(C)(C)C1C(=CC(O1)=O)C#CC1=CC=CC=C1
SPLASH splash10-004i-0930000000-a989001b724338c7ad61
Source of Spectrum QE-25-SM20-3a (DOI: 10.1002/chem.201902213)
Thin-Layer Chromatography 0.10 (PE/EA, 20:1)
Wiley ID 1893863