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benzyl p-bromophenyl sulfide
SpectraBase Compound ID GjLVKiutulI
InChI InChI=1S/C13H11BrS/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey XNMPJRAVZAWQMD-UHFFFAOYSA-N
Mol Weight 279.19 g/mol
Molecular Formula C13H11BrS
Exact Mass 277.976485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPkl3EJjiAu
Name 1-(Benzylsulfanyl)-4-bromobenzene
Appearance White plates
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Exact Mass 277.976484528 u
Formula C13H11BrS
InChI InChI=1S/C13H11BrS/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey XNMPJRAVZAWQMD-UHFFFAOYSA-N
Instrument Name Waters Micromass AutoSpec-Ultima
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703244
Quality 123
Reported Formula C13H11(81)BrS
SMILES C1(=CC=CC=C1)CSC1=CC=C(C=C1)Br
SPLASH splash10-0006-9030000000-aad24b5c2734dc7cb6c8
Source of Spectrum QE-23-SM70-64 (DOI: 10.1002/chem.201703244)
Thin-Layer Chromatography 0.68 (SiO2, cyclohexane/EtOAc, 95:05)
Wiley ID 1907863