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1-(m-Chlorophenyl)-4-methyl-6-phenyl-2[1H]pyrimidinethione
SpectraBase Compound ID E4rcEDXUIqL
InChI InChI=1S/C17H13ClN2S/c1-12-10-16(13-6-3-2-4-7-13)20(17(21)19-12)15-9-5-8-14(18)11-15/h2-11H,1H3
InChIKey BHFIPDWAROSWBG-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 F6KWFAY7k9o
Name 1-(m-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/c1-12-10-16(13-6-3-2-4-7-13)20(17(21)19-12)15-9-5-8-14(18)11-15/h2-11H,1H3
InChIKey BHFIPDWAROSWBG-UHFFFAOYSA-N
Molecular Weight 312.818 g/mol
SMILES C1(N(C(c2ccccc2)=CC(=N1)C)c1cc(Cl)ccc1)=S
SPLASH splash10-03di-0009000000-ed17a1e214f9ce64b7b1
Source of Spectrum O1-60-2755-4
Synonyms 1-(3-chlorophenyl)-4-methyl-6-phenyl-2(1H)-pyrimidinethione
Wiley ID 1592270