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(S)-(+)-2,5-Dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

View entire compound with spectra: 1 MS (GC)

(S)-(+)-2,5-Dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid
SpectraBase Compound ID IC5YeAV4uUf
InChI InChI=1S/C11H11NO4/c1-6-4-3-5-7-8(6)12-9(13)11(2,16-7)10(14)15/h3-5H,1-2H3,(H,12,13)(H,14,15)/t11-/m0/s1
InChIKey ISHHNQRFNZFNDU-NSHDSACASA-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 IL23gAIiy5V
Name (S)-(+)-2,5-Dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C11H11NO4
InChI InChI=1S/C11H11NO4/c1-6-4-3-5-7-8(6)12-9(13)11(2,16-7)10(14)15/h3-5H,1-2H3,(H,12,13)(H,14,15)/t11-/m0/s1
InChIKey ISHHNQRFNZFNDU-NSHDSACASA-N
Molecular Weight 221.212 g/mol
SMILES N1c2c(O[C@](C(=O)O)(C1=O)C)cccc2C
SPLASH splash10-004i-0920000000-4a933d3d2f3defcfbd8c
Source of Spectrum QC-10-159-5
Synonyms (2S)-2,5-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid
Wiley ID 871047