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Dimethyl 4-(p-methoxyphenyl)-5-phenylthiophene-2,3-dicarboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Dimethyl 4-(p-methoxyphenyl)-5-phenylthiophene-2,3-dicarboxylate
SpectraBase Compound ID HgqyZ3HCJl4
InChI InChI=1S/C21H18O5S/c1-24-15-11-9-13(10-12-15)16-17(20(22)25-2)19(21(23)26-3)27-18(16)14-7-5-4-6-8-14/h4-12H,1-3H3
InChIKey TZVOJKXLAYMUFY-UHFFFAOYSA-N
Mol Weight 382.43 g/mol
Molecular Formula C21H18O5S
Exact Mass 382.087495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DrI0XJu5i3Y
Name Dimethyl 4-(p-methoxyphenyl)-5-phenylthiophene-2,3-dicarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 382.087494849 u
Formula C21H18O5S
InChI InChI=1S/C21H18O5S/c1-24-15-11-9-13(10-12-15)16-17(20(22)25-2)19(21(23)26-3)27-18(16)14-7-5-4-6-8-14/h4-12H,1-3H3
InChIKey TZVOJKXLAYMUFY-UHFFFAOYSA-N
Molecular Weight 382.430 g/mol
SMILES C1(=C(C(=C(S1)C=1C=CC=CC1)C=1C=CC(=CC1)OC)C(=O)OC)C(=O)OC