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3-(1-(4-fluorophenyl)ethyl)-4-hydroxy-6-methyl-2H-pyran-2-one
SpectraBase Compound ID D06rOlvLeUt
InChI InChI=1S/C14H13FO3/c1-8-7-12(16)13(14(17)18-8)9(2)10-3-5-11(15)6-4-10/h3-7,9,16H,1-2H3
InChIKey FMQXBOHUFIPJBR-UHFFFAOYSA-N
Mol Weight 248.25 g/mol
Molecular Formula C14H13FO3
Exact Mass 248.084872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jfpejapLa7
Name 3-(1-(4-fluorophenyl)ethyl)-4-hydroxy-6-methyl-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13FO3
InChI InChI=1S/C14H13FO3/c1-8-7-12(16)13(14(17)18-8)9(2)10-3-5-11(15)6-4-10/h3-7,9,16H,1-2H3
InChIKey FMQXBOHUFIPJBR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000538
Molecular Weight 248.253 g/mol
SMILES OC1=C(C(OC(=C1)C)=O)C(C)c1ccc(cc1)F
SPLASH splash10-000j-7940000000-a44d4aa401b6e3ddfd1c
Source of Spectrum ASC-352-2961/SM7-5f
Wiley ID 1764106