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2-[(4-Methoxyphenyl)-(5-thiophen-2-yl-2-thiophenyl)methyl]-5-thiophen-2-ylthiophene
SpectraBase Compound ID GB4NVlQ0iVV
InChI InChI=1S/C24H18OS4/c1-25-17-8-6-16(7-9-17)24(22-12-10-20(28-22)18-4-2-14-26-18)23-13-11-21(29-23)19-5-3-15-27-19/h2-15,24H,1H3
InChIKey GSAFTHZAZQRJLR-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C24H18OS4
Exact Mass 450.02405 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JuHRqOgifR
Name 2-[(4-Methoxyphenyl)-(5-thiophen-2-yl-2-thiophenyl)methyl]-5-thiophen-2-ylthiophene
Comments Computed using HOSE algorithm
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Exact Mass 450.024049895 u
Formula C24H18OS4
InChI InChI=1S/C24H18OS4/c1-25-17-8-6-16(7-9-17)24(22-12-10-20(28-22)18-4-2-14-26-18)23-13-11-21(29-23)19-5-3-15-27-19/h2-15,24H,1H3
InChIKey GSAFTHZAZQRJLR-UHFFFAOYSA-N
Molecular Weight 450.647 g/mol
SMILES C=1(SC(C=2SC=CC2)=CC1)C(C=1SC(C=2SC=CC2)=CC1)C1=CC=C(C=C1)OC