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1-(5-bromo-6-methylpyridin-2-yl)ethan-1-one
SpectraBase Compound ID LgeUXX36DYF
InChI InChI=1S/C8H8BrNO/c1-5-7(9)3-4-8(10-5)6(2)11/h3-4H,1-2H3
InChIKey YKKHITFASBAXBZ-UHFFFAOYSA-N
Mol Weight 214.06 g/mol
Molecular Formula C8H8BrNO
Exact Mass 212.978927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9TrMqWgOq0
Name 1-(5-bromo-6-methylpyridin-2-yl)ethan-1-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8BrNO
InChI InChI=1S/C8H8BrNO/c1-5-7(9)3-4-8(10-5)6(2)11/h3-4H,1-2H3
InChIKey YKKHITFASBAXBZ-UHFFFAOYSA-N
Instrument Name Finnigan Mat 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202012496
Molecular Weight 214.062 g/mol
Reported Formula C8H8BrNO
SMILES c1cc(c(nc1C(=O)C)C)Br
SPLASH splash10-0079-2920000000-64825af5d19f0ce4aff2
Source of Spectrum ACI-60-SM39-14d
Thin-Layer Chromatography Rf = 0.39 (isohexane/ethyl acetate, 95:5)
Wiley ID 1880448