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methyl 4-[3-fluoro-1-(2-fluoroacetyl)oxy-2-(fluoromethyl)propyl]benzoate
SpectraBase Compound ID Fxha5NfdQHK
InChI InChI=1S/C14H15F3O4/c1-20-14(19)10-4-2-9(3-5-10)13(11(6-15)7-16)21-12(18)8-17/h2-5,11,13H,6-8H2,1H3
InChIKey UCHHDHKDOZBGLI-UHFFFAOYSA-N
Mol Weight 304.27 g/mol
Molecular Formula C14H15F3O4
Exact Mass 304.092243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uwMY8CzmC
Name methyl 4-[3-fluoro-1-(2-fluoroacetyl)oxy-2-(fluoromethyl)propyl]benzoate
Carrier Gas Helium (1.5 mL/min)
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15F3O4
GC Column DB-1MS (15 m ?? 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C14H15F3O4/c1-20-14(19)10-4-2-9(3-5-10)13(11(6-15)7-16)21-12(18)8-17/h2-5,11,13H,6-8H2,1H3
InChIKey UCHHDHKDOZBGLI-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202219027
Molecular Weight 304.265 g/mol
Quality 914
SMILES C1=CC(=CC=C1C(=O)OC)C(OC(CF)=O)C(CF)CF
SPLASH splash10-02w9-4920000000-29f53c3d7d40f32332fd
Source of Spectrum ACI-62-SM39-3l (DOI: 10.1002/anie.202219027)
Wiley ID 1908286