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4-Fluorobenzyl pentanoate
SpectraBase Compound ID KOjimJG4Ovb
InChI InChI=1S/C12H15FO2/c1-2-3-4-12(14)15-9-10-5-7-11(13)8-6-10/h5-8H,2-4,9H2,1H3
InChIKey YJYLLGUSUGCEPY-UHFFFAOYSA-N
Mol Weight 210.25 g/mol
Molecular Formula C12H15FO2
Exact Mass 210.105608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L6a3PqLXASP
Name 4-Fluorobenzyl pentanoate
Appearance Light-yellow oil
Carrier Gas Argon
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15FO2
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C12H15FO2/c1-2-3-4-12(14)15-9-10-5-7-11(13)8-6-10/h5-8H,2-4,9H2,1H3
InChIKey YJYLLGUSUGCEPY-UHFFFAOYSA-N
Instrument Name Agilent HP-7890A-AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202211939
Molecular Weight 210.248 g/mol
Quality 263
Reported Formula C12H15O2F
SMILES C1(F)=CC=C(C=C1)COC(CCCC)=O
SPLASH splash10-0a4i-3900000000-82138df334d47439ac37
Source of Spectrum ACI-61-SM39-46 (DOI: 10.1002/anie.202211939)
Wiley ID 1899561