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1-(4-Chlorophenyl)-4-methyl-6-phenyl-2[1H]pyrimidinethione
SpectraBase Compound ID GKrlISBhqAZ
InChI InChI=1S/C17H13ClN2S/c1-12-11-16(13-5-3-2-4-6-13)20(17(21)19-12)15-9-7-14(18)8-10-15/h2-11H,1H3
InChIKey OQSGWKNHEVKSCP-UHFFFAOYSA-N
Mol Weight 312.82 g/mol
Molecular Formula C17H13ClN2S
Exact Mass 312.048797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGhtZDtXTnd
Name 1-(4-Chlorophenyl)-4-methyl-6-phenyl-2[1H]pyrimidinethione
Comments Less than 3 mono-isotopic peaks
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Formula C17H13ClN2S
InChI InChI=1S/C17H13ClN2S/c1-12-11-16(13-5-3-2-4-6-13)20(17(21)19-12)15-9-7-14(18)8-10-15/h2-11H,1H3
InChIKey OQSGWKNHEVKSCP-UHFFFAOYSA-N
Molecular Weight 312.818 g/mol
SMILES C1(N(C(c2ccccc2)=CC(=N1)C)c1ccc(cc1)Cl)=S
SPLASH splash10-03di-0009000000-6ea79566deb8265175d0
Source of Spectrum O1-60-2754-4
Wiley ID 1592273