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2-bromo-5-(cyclohex-2-en-1-yl)-4-methylpyridine
SpectraBase Compound ID 4pJtfz5eypM
InChI InChI=1S/C12H14BrN/c1-9-7-12(13)14-8-11(9)10-5-3-2-4-6-10/h3,5,7-8,10H,2,4,6H2,1H3
InChIKey YOKYYJWNYOXZBK-UHFFFAOYSA-N
Mol Weight 252.15 g/mol
Molecular Formula C12H14BrN
Exact Mass 251.030962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QARGmvhI0
Name 2-bromo-5-(cyclohex-2-en-1-yl)-4-methylpyridine
Appearance Yellowish oil
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Formula C12H14BrN
InChI InChI=1S/C12H14BrN/c1-9-7-12(13)14-8-11(9)10-5-3-2-4-6-10/h3,5,7-8,10H,2,4,6H2,1H3
InChIKey YOKYYJWNYOXZBK-UHFFFAOYSA-N
Instrument Name Finnigan Mat 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202012496
Molecular Weight 252.155 g/mol
Reported Formula C12H14BrN
SMILES c1c(c(cnc1Br)C1C=CCCC1)C
SPLASH splash10-0fk9-0490000000-a33743522ba6b5b52dac
Source of Spectrum ACI-60-SM33-13c
Thin-Layer Chromatography Rf = 0.11 (isohexane/diethyl ether, 99:1)
Wiley ID 1880440