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6,8-Dimethyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde 3-O-methyl oxime
SpectraBase Compound ID DcdVS4aOG8b
InChI InChI=1S/C13H13NO3/c1-8-4-9(2)13-11(5-8)12(15)10(7-17-13)6-14-16-3/h4-7H,1-3H3/b14-6+
InChIKey JFPKCHUVWBYTDO-MKMNVTDBSA-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 JeyPvN4ZwgQ
Name 6,8-Dimethyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde 3-O-methyl oxime
Alternate Name(s) 3-[(E)-methoxyiminomethyl]-6,8-dimethyl-1-benzopyran-4-one 3-[(E)-methoxyiminomethyl]-6,8-dimethylchromen-4-one 3-[(E)-methoxyiminomethyl]-6,8-dimethyl-chromen-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-8-4-9(2)13-11(5-8)12(15)10(7-17-13)6-14-16-3/h4-7H,1-3H3/b14-6+
InChIKey JFPKCHUVWBYTDO-MKMNVTDBSA-N
Molecular Weight 231.251 g/mol
SMILES c12C(C(\C=N\OC)=COc2c(C)cc(c1)C)=O
SPLASH splash10-0udi-0090000000-1b15f3f6b504d7be727a
Source of Spectrum J-64-8739-16
Wiley ID 1531690