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4-(3-oxidanylidenebutan-2-ylamino)chromen-2-one
SpectraBase Compound ID CCqNRNSSqJ4
InChI InChI=1S/C13H13NO3/c1-8(9(2)15)14-11-7-13(16)17-12-6-4-3-5-10(11)12/h3-8,14H,1-2H3
InChIKey WALKEUOLKMKASO-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zJRIFNTmjA
Name 4-(3-oxidanylidenebutan-2-ylamino)chromen-2-one
Alternate Name(s) 4-(3-oxobutan-2-ylamino)-1-benzopyran-2-one 4-(3-oxobutan-2-ylamino)chromen-2-one 4-[(1-methyl-2-oxo-propyl)amino]chromen-2-one 4-[(2-keto-1-methyl-propyl)amino]coumarin
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-8(9(2)15)14-11-7-13(16)17-12-6-4-3-5-10(11)12/h3-8,14H,1-2H3
InChIKey WALKEUOLKMKASO-UHFFFAOYSA-N
Molecular Weight 231.251 g/mol
SMILES N(C1=CC(=O)Oc2c1cccc2)C(C(=O)C)C
SPLASH splash10-000i-0920000000-63fa5a24d567b8bc6fe7
Source of Spectrum F-55-13220-12
Wiley ID 839876