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3-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}-2H-chromen-2-one
SpectraBase Compound ID C9qQuOPlmdl
InChI InChI=1S/C15H12N2O3S/c1-17-7-6-16-15(17)21-9-12(18)11-8-10-4-2-3-5-13(10)20-14(11)19/h2-8H,9H2,1H3
InChIKey ZSSATGXJPVNFII-UHFFFAOYSA-N
Mol Weight 300.33 g/mol
Molecular Formula C15H12N2O3S
Exact Mass 300.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gypUIo1hHm
Name Coumarine, 3-[2-(1-methyl-2-imidazolylthio)-1-oxoethyl]-
Alternate Name(s) 3-([(1-Methyl-1H-imidazol-2-yl)sulfanyl]acetyl)-2H-chromen-2-one 3-[2-(1-methylimidazol-2-yl)sulfanylacetyl]chromen-2-one 3-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]chromen-2-one 3-[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]-1-benzopyran-2-one 3-[2-[(1-methylimidazol-2-yl)thio]acetyl]coumarin
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Formula C15H12N2O3S
InChI InChI=1S/C15H12N2O3S/c1-17-7-6-16-15(17)21-9-12(18)11-8-10-4-2-3-5-13(10)20-14(11)19/h2-8H,9H2,1H3
InChIKey ZSSATGXJPVNFII-UHFFFAOYSA-N
Molecular Weight 300.332 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)C(CSc1[n](ccn1)C)=O
SPLASH splash10-004i-7910000000-0f9e4f9fb0b3bf15dfe4
Source of Spectrum AD-0-2532-0
Wiley ID 1427762