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Diethyl 4'-(4-methoxyphenyl)-Tetrathiafulvalene-4,5-dicarboxylate
SpectraBase Compound ID 8JLOjJz361m
InChI InChI=1S/C19H18O5S4/c1-4-23-16(20)14-15(17(21)24-5-2)28-19(27-14)18-25-10-13(26-18)11-6-8-12(22-3)9-7-11/h6-10H,4-5H2,1-3H3
InChIKey MUAQFQYJUBCDRC-UHFFFAOYSA-N
Mol Weight 454.6 g/mol
Molecular Formula C19H18O5S4
Exact Mass 454.003708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qr2XpWfbYi
Name Diethyl 4'-(4-methoxyphenyl)-Tetrathiafulvalene-4,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O5S4
InChI InChI=1S/C19H18O5S4/c1-4-23-16(20)14-15(17(21)24-5-2)28-19(27-14)18-25-10-13(26-18)11-6-8-12(22-3)9-7-11/h6-10H,4-5H2,1-3H3
InChIKey MUAQFQYJUBCDRC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.5b02715
Molecular Weight 454.588 g/mol
SMILES C1(SC=C(c2ccc(OC)cc2)S1)=C1SC(C(OCC)=O)=C(C(OCC)=O)S1
SPLASH splash10-0zfr-1323900000-c5b6786a7044a9149301
Source of Spectrum A1-17-5356/SM32-8e
Synonyms Diethyl 4'-(4-methoxyphenyl)-[2,2'-bi(1,3-dithiolylidene)]-4,5-dicarboxylate
Wiley ID 1802605