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4-(1-benzothiophen-2-yl)-2-chloranyl-6-thiophen-2-yl-pyrimidine
SpectraBase Compound ID DKowOfCMuec
InChI InChI=1S/C16H9ClN2S2/c17-16-18-11(14-6-3-7-20-14)9-12(19-16)15-8-10-4-1-2-5-13(10)21-15/h1-9H
InChIKey RWNLMWMTYWGANB-UHFFFAOYSA-N
Mol Weight 328.84 g/mol
Molecular Formula C16H9ClN2S2
Exact Mass 327.989568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bi6pREDdYKj
Name 4-(1-benzothiophen-2-yl)-2-chloranyl-6-thiophen-2-yl-pyrimidine
Alternate Name(s) 4-(1-benzothiophen-2-yl)-2-chloro-6-thiophen-2-ylpyrimidine 4-(benzothiophen-2-yl)-2-chloro-6-(2-thienyl)pyrimidine
CAS Registry Number 115419-75-5
Comments Less than 3 mono-isotopic peaks
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Formula C16H9ClN2S2
InChI InChI=1S/C16H9ClN2S2/c17-16-18-11(14-6-3-7-20-14)9-12(19-16)15-8-10-4-1-2-5-13(10)21-15/h1-9H
InChIKey RWNLMWMTYWGANB-UHFFFAOYSA-N
Molecular Weight 328.835 g/mol
SMILES c1(sc2ccccc2c1)-c1nc(Cl)nc(c1)-c1sccc1
SPLASH splash10-004i-0009000000-e0d878cb650db4b5304b
Source of Spectrum Y-27-1398-33
Wiley ID 1326018