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3-Pyridinyl thiocyanate
SpectraBase Compound ID 3SLtwZ8xDYI
InChI InChI=1S/C6H4N2S/c7-5-9-6-2-1-3-8-4-6/h1-4H
InChIKey OYKDNXIKMAQMJG-UHFFFAOYSA-N
Mol Weight 136.17 g/mol
Molecular Formula C6H4N2S
Exact Mass 136.009519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhviJLIwfMU
Name 3-pyridinyl thiocyanate
Appearance Yellow liquid
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Exact Mass 136.009519311 u
Formula C6H4N2S
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C6H4N2S/c7-5-9-6-2-1-3-8-4-6/h1-4H
InChIKey OYKDNXIKMAQMJG-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Quality 117
Reported Formula C6H4N2S
SMILES C1=NC=CC=C1SC#N
SPLASH splash10-000i-1900000000-fbd4a9811a9b35704170
Source of Spectrum QE-21-SM19-1u (DOI: 10.1002/chem.201503915)
Wiley ID 1907349