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2,2'-(1,4-Phenylen)bis(5-phenyl-3-thiophencarboxylate-methylester)
SpectraBase Compound ID J00JVe6hmTG
InChI InChI=1S/C30H22O4S2/c1-33-29(31)23-17-25(19-9-5-3-6-10-19)35-27(23)21-13-15-22(16-14-21)28-24(30(32)34-2)18-26(36-28)20-11-7-4-8-12-20/h3-18H,1-2H3
InChIKey LZJTWCFVKCMYNA-UHFFFAOYSA-N
Mol Weight 510.62 g/mol
Molecular Formula C30H22O4S2
Exact Mass 510.095952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HU6DhN80Wuw
Name 2,2'-(1,4-Phenylen)bis(5-phenyl-3-thiophencarboxylate-methylester)
Alternate Name(s) Dimethyl 2,2'-(1,4-phenylene)bis(5-phenylthiophene-3-carboxylate)
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Formula C30H22O4S2
InChI InChI=1S/C30H22O4S2/c1-33-29(31)23-17-25(19-9-5-3-6-10-19)35-27(23)21-13-15-22(16-14-21)28-24(30(32)34-2)18-26(36-28)20-11-7-4-8-12-20/h3-18H,1-2H3
InChIKey LZJTWCFVKCMYNA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19881210218
Molecular Weight 510.622 g/mol
SMILES c1(sc(c(c1)C(=O)OC)-c1ccc(cc1)-c1sc(cc1C(OC)=O)-c1ccccc1)-c1ccccc1
SPLASH splash10-03di-1300290000-df32307d094b527f1628
Source of Spectrum K-121-320-14b
Wiley ID 1799283