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MRXFPZAGQYIQMD-DUNJVVEMSA-N

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MRXFPZAGQYIQMD-DUNJVVEMSA-N
SpectraBase Compound ID Klp01upGnYn
InChI InChI=1S/C9H10O2.C6H7BN4.2C4H6N2.CO.Re/c1-6-8(5-10)3-4-9(6)7(2)11;1-3-8-10(5-1)7-11-6-2-4-9-11;1-6-3-2-5-4-6;1-6-4-2-3-5-6;1-2;/h5-6,8-9H,1-2H3;1-7H;2*2-4H,1H3;;/t6-,8-,9-;;;;;/m1...../s1
InChIKey MRXFPZAGQYIQMD-DUNJVVEMSA-N
Mol Weight 674.6 g/mol
Molecular Formula C24H29BN8O3Re
Exact Mass 675.201319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JuVHt94sYuC
Name MRXFPZAGQYIQMD-DUNJVVEMSA-N
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H29BN8O3Re
InChI InChI=1S/C9H10O2.C6H7BN4.2C4H6N2.CO.Re/c1-6-8(5-10)3-4-9(6)7(2)11;1-3-8-10(5-1)7-11-6-2-4-9-11;1-6-3-2-5-4-6;1-6-4-2-3-5-6;1-2;/h5-6,8-9H,1-2H3;1-7H;2*2-4H,1H3;;/t6-,8-,9-;;;;;/m1...../s1
InChIKey MRXFPZAGQYIQMD-DUNJVVEMSA-N
Literature Reference Author L.A.FRIEDMAN,F.YOU,M.SABAT,W.D.HARMAN
Literature Reference Citation J.AM.CHEM.SOC.,125,14980(2003)
Literature Reference DOI 10.1021/ja0304143
Molecular Weight 674.563 g/mol
Sample ID 35342
Solvent CD3CN