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3-Bromo-4-(thien-3-yl)pyridine
SpectraBase Compound ID FFA81ZMNGxU
InChI InChI=1S/C9H6BrNS/c10-9-5-11-3-1-8(9)7-2-4-12-6-7/h1-6H
InChIKey SYNHYBAJPXRXRK-UHFFFAOYSA-N
Mol Weight 240.12 g/mol
Molecular Formula C9H6BrNS
Exact Mass 238.940433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yM4SWzV1F1
Name 3-Bromo-4-(thien-3-yl)pyridine
Appearance Yellow oil
Carrier Gas Helium
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Exact Mass 238.940433371 u
Formula C9H6BrNS
InChI InChI=1S/C9H6BrNS/c10-9-5-11-3-1-8(9)7-2-4-12-6-7/h1-6H
InChIKey SYNHYBAJPXRXRK-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95-XP
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202101306
Molecular Weight 240.118 g/mol
Quality 493
Reported Formula C9H6NBrS
SMILES C=1(Br)C=NC=CC1C1=CSC=C1
SPLASH splash10-01pc-7290000000-c655640b353238475dd4
Source of Spectrum K1-2022-6-1a (DOI: 10.1002/ejoc.202101306)
Thin-Layer Chromatography 0.30 (Heptane/EtOAc, 5:1)
Wiley ID 1899009