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2-(3-keto-1,4-benzoxazin-4-yl)acetic acid methyl ester
SpectraBase Compound ID fjMUkqPHqQ
InChI InChI=1S/C11H11NO4/c1-15-11(14)6-12-8-4-2-3-5-9(8)16-7-10(12)13/h2-5H,6-7H2,1H3
InChIKey GRKABAHGNIWBSD-UHFFFAOYSA-N
Mol Weight 221.21 g/mol
Molecular Formula C11H11NO4
Exact Mass 221.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HcqG4aO9XMa
Name 2-(3-keto-1,4-benzoxazin-4-yl)acetic acid methyl ester
Alternate Name(s) 2-(3-oxo-1,4-benzoxazin-4-yl)acetic acid methyl ester methyl (3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetate methyl 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate methyl 2-(3-oxo-1,4-benzoxazin-4-yl)acetate
Comments Less than 3 mono-isotopic peaks
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Formula C11H11NO4
InChI InChI=1S/C11H11NO4/c1-15-11(14)6-12-8-4-2-3-5-9(8)16-7-10(12)13/h2-5H,6-7H2,1H3
InChIKey GRKABAHGNIWBSD-UHFFFAOYSA-N
Molecular Weight 221.212 g/mol
SMILES C(CN1C(COc2c1cccc2)=O)(=O)OC
SPLASH splash10-0229-0790000000-f697fb64181fc82ddde0
Source of Spectrum K-2002-1205-5
Wiley ID 1581486