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(Z)-methyl 4-((4-oxo-2H-thiopyran-3 (4H,5H,6H) -ylidene) methyl) benzoate
SpectraBase Compound ID LbADrkMWYoP
InChI InChI=1S/C14H14O3S/c1-17-14(16)11-4-2-10(3-5-11)8-12-9-18-7-6-13(12)15/h2-5,8H,6-7,9H2,1H3/b12-8+
InChIKey CNCKJORSRQWETL-XYOKQWHBSA-N
Mol Weight 262.32 g/mol
Molecular Formula C14H14O3S
Exact Mass 262.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qEQDNKvPI3
Name (Z)-methyl 4-((4-oxo-2H-thiopyran-3 (4H,5H,6H) -ylidene) methyl) benzoate
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Formula C14H14O3S
InChI InChI=1S/C14H14O3S/c1-17-14(16)11-4-2-10(3-5-11)8-12-9-18-7-6-13(12)15/h2-5,8H,6-7,9H2,1H3/b12-8+
InChIKey CNCKJORSRQWETL-XYOKQWHBSA-N
Literature Reference DOI 10.1080/00397911.2013.786089
Molecular Weight 262.323 g/mol
SMILES C1CSC\C(C1=O)=C/c1ccc(cc1)C(=O)OC
SPLASH splash10-00kb-3920000000-de66484fb70af17b7c76
Source of Spectrum B1-43-3357/SM30-A10
Synonyms (Z)-methyl 4-((4-oxodihydro-2H-thiopyran-3(4H)-ylidene)methyl)benzoate
Wiley ID 1757512