John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=15WnissO4fL SpectraBase Spectrum ID=ITUIuXIxknM

(accessed ).
8-METHYL-4,5,11,12-TETRAHYDRO-7H-ISOXAZOLO-[3,4-E]-PYRIMIDO-[1,2-A]-[1,3]-DIAZOCINE-7,12-DIONE
SpectraBase Compound ID 15WnissO4fL
InChI InChI=1S/C11H10N4O3/c1-6-4-12-11-13-9(16)8-7(5-18-14-8)2-3-15(11)10(6)17/h4-5H,2-3H2,1H3,(H,12,13,16)
InChIKey ZUEQZPFWVMMUQC-UHFFFAOYSA-N
Mol Weight 246.23 g/mol
Molecular Formula C11H10N4O3
Exact Mass 246.07529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITUIuXIxknM
Name 8-METHYL-4,5,11,12-TETRAHYDRO-7H-ISOXAZOLO-[3,4-E]-PYRIMIDO-[1,2-A]-[1,3]-DIAZOCINE-7,12-DIONE
Compound Number 1 0B
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10N4O3
InChI InChI=1S/C11H10N4O3/c1-6-4-12-11-13-9(16)8-7(5-18-14-8)2-3-15(11)10(6)17/h4-5H,2-3H2,1H3,(H,12,13,16)
InChIKey ZUEQZPFWVMMUQC-UHFFFAOYSA-N
Literature Reference Author C.PEREZ,Y.L.JANIN,D.R.ADAMS,C.MONNERET,D.S.GRIERSON
Literature Reference Citation J.CHEM.SOC.PERKIN-1,901(1997)
Literature Reference DOI 10.1039/a605995c
Molecular Weight 246.225 g/mol
Solvent DMSO-D6
SpectraBase Batch ID 3kK8MOyBfOk