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(Z)-1-(4-methoxyphenyl)-3-(methylthio)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate
SpectraBase Compound ID 7gnhPDaftFA
InChI InChI=1S/C16H15NO2S2/c1-19-13-8-6-12(7-9-13)15(18)14(16(20)21-2)17-10-4-3-5-11-17/h3-11H,1-2H3
InChIKey SCBXLOKDZIVWAN-UHFFFAOYSA-N
Mol Weight 317.42 g/mol
Molecular Formula C16H15NO2S2
Exact Mass 317.054421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MH2GrwjyoV
Name (Z)-1-(4-methoxyphenyl)-3-(methylthio)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate
CAS Registry Number 112777-15-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO2S2
InChI InChI=1S/C16H15NO2S2/c1-19-13-8-6-12(7-9-13)15(18)14(16(20)21-2)17-10-4-3-5-11-17/h3-11H,1-2H3
InChIKey SCBXLOKDZIVWAN-UHFFFAOYSA-N
Molecular Weight 317.421 g/mol
SMILES C(=n1ccccc1)(C(c1ccc(cc1)OC)=O)C(=S)SC
SPLASH splash10-0g4i-1795000000-a1c7d9ef7eb8f73fd70f
Source of Spectrum Y-24-924-11
Synonyms (Z)-1-(4-methoxyphenyl)-3-(methylthio)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate (Z)-1-(4-methoxyphenyl)-3-methylsulfanyl-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate (Z)-1-(4-methoxyphenyl)-3-methylsulfanyl-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate
Wiley ID 1317588