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RAC-CYCLOOROIDIN;RAC-4-(2-AMINO-3H-IMIDAZOL-4-YLMETHYL)-6,7-DIBROMO-3,4-DIHYDRO-2H-PYRROLO-[1,2-A]-PYRAZIN-1-ONE
SpectraBase Compound ID GXfbU2jXO0T
InChI InChI=1S/C11H11Br2N5O.CH2O2/c12-7-2-8-10(19)15-4-6(18(8)9(7)13)1-5-3-16-11(14)17-5;2-1-3/h2-3,6H,1,4H2,(H,15,19)(H3,14,16,17);1H,(H,2,3)
InChIKey XWJCKTARLUJEIX-UHFFFAOYSA-N
Mol Weight 435.08 g/mol
Molecular Formula C12H13Br2N5O3
Exact Mass 432.938515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpDXmxHXA2R
Name RAC-CYCLOOROIDIN;RAC-4-(2-AMINO-3H-IMIDAZOL-4-YLMETHYL)-6,7-DIBROMO-3,4-DIHYDRO-2H-PYRROLO-[1,2-A]-PYRAZIN-1-ONE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13Br2N5O3
InChI InChI=1S/C11H11Br2N5O.CH2O2/c12-7-2-8-10(19)15-4-6(18(8)9(7)13)1-5-3-16-11(14)17-5;2-1-3/h2-3,6H,1,4H2,(H,15,19)(H3,14,16,17);1H,(H,2,3)
InChIKey XWJCKTARLUJEIX-UHFFFAOYSA-N
Literature Reference Author C.POEVERLEIN,G.BRECKLE,T.LINDEL
Literature Reference Citation ORG.LETTERS,8,819(2006)
Literature Reference DOI 10.1021/ol0526219
Molecular Weight 435.075 g/mol
Sample ID 39939
Solvent CD3OD