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[1,1'-biphenyl]-2-yl thiocyanate
SpectraBase Compound ID G7p8efoBsyW
InChI InChI=1S/C13H9NS/c14-10-15-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9H
InChIKey DKHLLLKAKZIBIF-UHFFFAOYSA-N
Mol Weight 211.28 g/mol
Molecular Formula C13H9NS
Exact Mass 211.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ns7mfUano
Name [1,1'-biphenyl]-2-yl thiocyanate
Appearance Yellow liquid
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Exact Mass 211.045570468 u
Formula C13H9NS
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C13H9NS/c14-10-15-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9H
InChIKey DKHLLLKAKZIBIF-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 211.282 g/mol
Quality 317
Reported Formula C13H9NS
SMILES C1=CC(=C(C=C1)C1=CC=CC=C1)SC#N
SPLASH splash10-03e9-0790000000-2a0823812c4528a9bdb6
Source of Spectrum QE-21-SM13-1k (DOI: 10.1002/chem.201503915)
Wiley ID 1907339