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2-(1-benzyl-2,2,6-trimethyl-3-thioxo-4-quinolylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID D1VCB0WVF9p
InChI InChI=1S/C26H25NO4S3/c1-15-11-12-18-17(13-15)19(25-33-20(23(28)30-4)21(34-25)24(29)31-5)22(32)26(2,3)27(18)14-16-9-7-6-8-10-16/h6-13H,14H2,1-5H3
InChIKey AWSMXEMMRCGTMF-UHFFFAOYSA-N
Mol Weight 511.67 g/mol
Molecular Formula C26H25NO4S3
Exact Mass 511.094572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L204iixArcZ
Name 2-(1-benzyl-2,2,6-trimethyl-3-thioxo-4-quinolylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester
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Formula C26H25NO4S3
InChI InChI=1S/C26H25NO4S3/c1-15-11-12-18-17(13-15)19(25-33-20(23(28)30-4)21(34-25)24(29)31-5)22(32)26(2,3)27(18)14-16-9-7-6-8-10-16/h6-13H,14H2,1-5H3
InChIKey AWSMXEMMRCGTMF-UHFFFAOYSA-N
Molecular Weight 511.669 g/mol
SMILES C1(=C2SC(C(=O)OC)=C(S2)C(=O)OC)C(C(C)(C)N(c2c1cc(cc2)C)Cc1ccccc1)=S
SPLASH splash10-0006-9230100000-05377dac2f4ecfc7bebd
Synonyms 2-[2,2,6-trimethyl-1-(phenylmethyl)-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Dimethyl 2-(1-benzyl-2,2,6-trimethyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate Dimethyl 2-(1-benzyl-2,2,6-trimethyl-3-thioxo-4-quinolylidene)-1,3-dithiole-4,5-dicarboxylate Dimethyl 2-[2,2,6-trimethyl-1-(phenylmethyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate
Wiley ID 1447239