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(3a,4Ab, 8B)-4,4a,7,8-tetrahydro-1-oxo-3-pentyl-1H,3H-pyrido(1,2-C)(1,3)oxazine-9-carboxylic acid
SpectraBase Compound ID 1NxWxLGD6dj
InChI InChI=1S/C14H21NO4/c1-2-3-4-7-11-9-10-6-5-8-12(13(16)17)15(10)14(18)19-11/h5-6,10-12H,2-4,7-9H2,1H3,(H,16,17)
InChIKey XWVJPWSKOCYALW-UHFFFAOYSA-N
Mol Weight 267.32 g/mol
Molecular Formula C14H21NO4
Exact Mass 267.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HYyewZRjuNQ
Name (3a,4Ab, 8B)-4,4a,7,8-tetrahydro-1-oxo-3-pentyl-1H,3H-pyrido(1,2-C)(1,3)oxazine-9-carboxylic acid
CAS Registry Number 89578-65-4
Comments reassigned
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Formula C14H21NO4
InChI InChI=1S/C14H21NO4/c1-2-3-4-7-11-9-10-6-5-8-12(13(16)17)15(10)14(18)19-11/h5-6,10-12H,2-4,7-9H2,1H3,(H,16,17)
InChIKey XWVJPWSKOCYALW-UHFFFAOYSA-N
Literature Reference T.R. Bailey, R.S. Garigipati, J.A.Morton, J. Am. Chem. Soc. 106, 3241 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3