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3,4-Thiophenedicarboxylic acid, 2,2'-(2,6-naphthalenediyl)bis[5-methyl-, tetramethyl ester
SpectraBase Compound ID DCgzic6fLax
InChI InChI=1S/C28H24O8S2/c1-13-19(25(29)33-3)21(27(31)35-5)23(37-13)17-9-7-16-12-18(10-8-15(16)11-17)24-22(28(32)36-6)20(14(2)38-24)26(30)34-4/h7-12H,1-6H3
InChIKey JYPPSBTWEXQGBR-UHFFFAOYSA-N
Mol Weight 552.61 g/mol
Molecular Formula C28H24O8S2
Exact Mass 552.09126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLnJ9x2dSEd
Name 3,4-Thiophenedicarboxylic acid, 2,2'-(2,6-naphthalenediyl)bis[5-methyl-, tetramethyl ester
CAS Registry Number 110699-40-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24O8S2
InChI InChI=1S/C28H24O8S2/c1-13-19(25(29)33-3)21(27(31)35-5)23(37-13)17-9-7-16-12-18(10-8-15(16)11-17)24-22(28(32)36-6)20(14(2)38-24)26(30)34-4/h7-12H,1-6H3
InChIKey JYPPSBTWEXQGBR-UHFFFAOYSA-N
Molecular Weight 552.612 g/mol
SMILES c1(c(sc(c1C(=O)OC)C)-c1cc2ccc(-c3c(c(C(=O)OC)c(s3)C)C(=O)OC)cc2cc1)C(=O)OC
SPLASH splash10-0udi-0010090000-fea8a3e871b464613a90
Source of Spectrum K-121-320-9
Synonyms Dimethyl 2-{6-[3,4-bis(methoxycarbonyl)-5-methyl-2-thienyl]-2-naphthyl}-5-methyl-3,4-thiophenedicarboxylate
Wiley ID 1405925