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2-Methyl-6,7-bis(ethoxycarbonyl)tetrathiafulvalene
SpectraBase Compound ID 8qBr4KfxqgT
InChI InChI=1S/C13H14O4S4/c1-4-16-10(14)8-9(11(15)17-5-2)21-13(20-8)12-18-6-7(3)19-12/h6H,4-5H2,1-3H3
InChIKey MOHLQTILHZTLHX-UHFFFAOYSA-N
Mol Weight 362.5 g/mol
Molecular Formula C13H14O4S4
Exact Mass 361.977494 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FEAZZ12CtrL
Name 2-Methyl-6,7-bis(ethoxycarbonyl)tetrathiafulvalene
Alternate Name(s) 2-(4-Methyl-1,3-dithiol-2-ylidene)-1,3-dithiole-4,5-dicarboxylic acid diethyl ester Diethyl 2-(4-methyl-1,3-dithiol-2-ylidene)-1,3-dithiole-4,5-dicarboxylate
CAS Registry Number 68128-95-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4S4
InChI InChI=1S/C13H14O4S4/c1-4-16-10(14)8-9(11(15)17-5-2)21-13(20-8)12-18-6-7(3)19-12/h6H,4-5H2,1-3H3
InChIKey MOHLQTILHZTLHX-UHFFFAOYSA-N
Molecular Weight 362.491 g/mol
SMILES C1(SC=C(S1)C)=C1SC(C(OCC)=O)=C(S1)C(OCC)=O
SPLASH splash10-03di-7985000000-194ddc1a33d6ce611125
Source of Spectrum W5-1989-9442-1
Wiley ID 1349240