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4H-1,4-Benzoxazine, propanoic acid deriv.
SpectraBase Compound ID DMpuAMa3NR7
InChI InChI=1S/C13H16N2O3/c1-9-8-18-12-7-5-4-6-11(12)15(9)14-10(2)13(16)17-3/h4-7,9H,8H2,1-3H3/b14-10+
InChIKey UIMTXSFJSIXWKB-GXDHUFHOSA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzfmDMMDA2O
Name 4H-1,4-Benzoxazine, propanoic acid deriv.
CAS Registry Number 97456-13-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-9-8-18-12-7-5-4-6-11(12)15(9)14-10(2)13(16)17-3/h4-7,9H,8H2,1-3H3/b14-10+
InChIKey UIMTXSFJSIXWKB-GXDHUFHOSA-N
Molecular Weight 248.282 g/mol
SMILES C(\C(=N\N1c2c(cccc2)OCC1C)C)(=O)OC
SPLASH splash10-0002-3920000000-5b9f2e5a9648ed79ff82
Source of Spectrum KC-1987-2083-0
Synonyms Propanoic acid, 2-[(2,3-dihydro-3-methyl-4H-1,4-benzoxazin-4-yl)imino]-, methyl ester, (.+-.)- Methyl (2E)-2-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)imino]propanoate Methyl pyruvate derivative of N-amino-3-methyl-3,4-dihydro-2H-1,4-benzoxazine
Wiley ID 1250948