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(3E)-3-[(tert-butylamino)methylene]-4-thioxo-chroman-2-one
SpectraBase Compound ID BZEdWtD9qsu
InChI InChI=1S/C14H15NO2S/c1-14(2,3)15-8-10-12(18)9-6-4-5-7-11(9)17-13(10)16/h4-8,15H,1-3H3/b10-8-
InChIKey GMIAZXGFAHPTPM-NTMALXAHSA-N
Mol Weight 261.34 g/mol
Molecular Formula C14H15NO2S
Exact Mass 261.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEf6PMsdYL8
Name (3E)-3-[(tert-butylamino)methylene]-4-thioxo-chroman-2-one
Alternate Name(s) (3E)-3-[(tert-butylamino)methylidene]-4-sulfanylidene-3,4-dihydro-2H-1-benzopyran-2-one (3E)-3-[(tert-butylamino)methylidene]-4-sulfanylidene-chromen-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H15NO2S
InChI InChI=1S/C14H15NO2S/c1-14(2,3)15-8-10-12(18)9-6-4-5-7-11(9)17-13(10)16/h4-8,15H,1-3H3/b10-8-
InChIKey GMIAZXGFAHPTPM-NTMALXAHSA-N
Molecular Weight 261.339 g/mol
SMILES N(\C=C\1C(c2ccccc2OC1=O)=S)C(C)(C)C
SPLASH splash10-0udi-0090000000-dbe522f4189dd32663ca
Source of Spectrum KC-0-2424-1
Wiley ID 821295