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3'-Methyl-3-(pyridin-2-ylthio)-[1,1'-biphenyl]-2-carbonitrile
SpectraBase Compound ID BE8tFojq6OF
InChI InChI=1S/C19H14N2S/c1-14-6-4-7-15(12-14)16-8-5-9-18(17(16)13-20)22-19-10-2-3-11-21-19/h2-12H,1H3
InChIKey DGTCQWYBPMAZKA-UHFFFAOYSA-N
Mol Weight 302.4 g/mol
Molecular Formula C19H14N2S
Exact Mass 302.08777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INNVzF540fX
Name 3'-Methyl-3-(pyridin-2-ylthio)-[1,1'-biphenyl]-2-carbonitrile
Appearance White solid
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Exact Mass 302.087769633 u
Formula C19H14N2S
InChI InChI=1S/C19H14N2S/c1-14-6-4-7-15(12-14)16-8-5-9-18(17(16)13-20)22-19-10-2-3-11-21-19/h2-12H,1H3
InChIKey DGTCQWYBPMAZKA-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95Q or HEWLETT-PACKARD HP 6890-MSD 5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103700
Molecular Weight 302.395 g/mol
Reported Formula C19H14N2S
SMILES C1(=C(C(=CC=C1)C1=CC=CC(=C1)C)C#N)SC1=NC=CC=C1
SPLASH splash10-0udi-0029000000-185d22660e04df6c1561
Source of Spectrum QE-28-SM72-5a (DOI: 10.1002/chem.202103700)
Wiley ID 1898246