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2-allyl-5-bromo-4-chloro-3-fluoropyridine
SpectraBase Compound ID JE3O1OW80ud
InChI InChI=1S/C8H6BrClFN/c1-2-3-6-8(11)7(10)5(9)4-12-6/h2,4H,1,3H2
InChIKey OCJQMCDGMIHQBA-UHFFFAOYSA-N
Mol Weight 250.5 g/mol
Molecular Formula C8H6BrClFN
Exact Mass 248.935618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IlNCHKsVuu8
Name 2-allyl-5-bromo-4-chloro-3-fluoropyridine
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6BrClFN
InChI InChI=1S/C8H6BrClFN/c1-2-3-6-8(11)7(10)5(9)4-12-6/h2,4H,1,3H2
InChIKey OCJQMCDGMIHQBA-UHFFFAOYSA-N
Instrument Name Finnigan Mat 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202012496
Molecular Weight 250.498 g/mol
Reported Formula C8H6BrClFN
SMILES c1(c(c(cnc1CC=C)Br)Cl)F
SPLASH splash10-0udj-0290000000-4ac9d258d83cf570859d
Source of Spectrum ACI-60-SM40-14e
Thin-Layer Chromatography Rf = 0.15 (isohexane)
Wiley ID 1880449