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5-[(t-Butyl)sulfanyl]-2-oxo-2H-(1)-benzopyran-6-carbaldehyde
SpectraBase Compound ID 8G069USHfIn
InChI InChI=1S/C14H14O3S/c1-14(2,3)18-13-9(8-15)4-6-11-10(13)5-7-12(16)17-11/h4-8H,1-3H3
InChIKey TZXZFPHFKDVXSK-UHFFFAOYSA-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 AxbqbcsWqpB
Name 5-[(t-Butyl)sulfanyl]-2-oxo-2H-(1)-benzopyran-6-carbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C14H14O3S
InChI InChI=1S/C14H14O3S/c1-14(2,3)18-13-9(8-15)4-6-11-10(13)5-7-12(16)17-11/h4-8H,1-3H3
InChIKey TZXZFPHFKDVXSK-UHFFFAOYSA-N
Molecular Weight 262.323 g/mol
SMILES c12c(SC(C)(C)C)c(C=O)ccc2OC(=O)C=C1
SPLASH splash10-0a4i-9000000000-62773c3ec3d574f4d350
Source of Spectrum H-85-550-21
Synonyms 5-(tert-butylsulfanyl)-2-oxo-2H-chromene-6-carbaldehyde
Wiley ID 1524111