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3,4-Thiophenedicarboxylic acid, 2,2'-[1,1'-biphenyl]-4,4'-diylbis[5-methyl-, tetramethyl ester
SpectraBase Compound ID 1muqomfBaOy
InChI InChI=1S/C30H26O8S2/c1-15-21(27(31)35-3)23(29(33)37-5)25(39-15)19-11-7-17(8-12-19)18-9-13-20(14-10-18)26-24(30(34)38-6)22(16(2)40-26)28(32)36-4/h7-14H,1-6H3
InChIKey OIJUAXMLPPOSHR-UHFFFAOYSA-N
Mol Weight 578.65 g/mol
Molecular Formula C30H26O8S2
Exact Mass 578.10691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TGIpXhr4C
Name 3,4-Thiophenedicarboxylic acid, 2,2'-[1,1'-biphenyl]-4,4'-diylbis[5-methyl-, tetramethyl ester
Alternate Name(s) Dimethyl 2-{4'-[3,4-bis(methoxycarbonyl)-5-methyl-2-thienyl][1,1'-biphenyl]-4-yl}-5-methyl-3,4-thiophenedicarboxylate
CAS Registry Number 110699-39-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H26O8S2
InChI InChI=1S/C30H26O8S2/c1-15-21(27(31)35-3)23(29(33)37-5)25(39-15)19-11-7-17(8-12-19)18-9-13-20(14-10-18)26-24(30(34)38-6)22(16(2)40-26)28(32)36-4/h7-14H,1-6H3
InChIKey OIJUAXMLPPOSHR-UHFFFAOYSA-N
Molecular Weight 578.650 g/mol
SMILES c1(c(c(C)sc1-c1ccc(-c2ccc(-c3c(c(C(=O)OC)c(s3)C)C(=O)OC)cc2)cc1)C(=O)OC)C(=O)OC
SPLASH splash10-004i-0010190000-333acc01bf324c9b280f
Source of Spectrum K-121-320-9
Wiley ID 1408343