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(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylic acid
SpectraBase Compound ID LnbjUYjSBcY
InChI InChI=1S/C10H9NO4/c1-10(9(13)14)8(12)11-6-4-2-3-5-7(6)15-10/h2-5H,1H3,(H,11,12)(H,13,14)/t10-/m0/s1
InChIKey HNDTULADLKGMDH-JTQLQIEISA-N
Mol Weight 207.19 g/mol
Molecular Formula C10H9NO4
Exact Mass 207.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5z6k1RjqPrX
Name (2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylic acid
Alternate Name(s) (2S)-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid (2S)-3-keto-2-methyl-4H-1,4-benzoxazine-2-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C10H9NO4
InChI InChI=1S/C10H9NO4/c1-10(9(13)14)8(12)11-6-4-2-3-5-7(6)15-10/h2-5H,1H3,(H,11,12)(H,13,14)/t10-/m0/s1
InChIKey HNDTULADLKGMDH-JTQLQIEISA-N
Molecular Weight 207.185 g/mol
SMILES N1c2c(O[C@](C(=O)O)(C1=O)C)cccc2
SPLASH splash10-03di-0920000000-259849de45516f7ca026
Source of Spectrum QC-10-159-5
Wiley ID 871048