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8-BrOMOARISTEROMYCIN

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8-BrOMOARISTEROMYCIN
SpectraBase Compound ID E0boZx68S41
InChI InChI=1S/C11H14BrN5O3/c12-11-16-6-9(13)14-3-15-10(6)17(11)5-1-4(2-18)7(19)8(5)20/h3-5,7-8,18-20H,1-2H2,(H2,13,14,15)/t4-,5-,7-,8+/m0/s1
InChIKey WMTPWABIISCXPZ-BKMCOVHNSA-N
Mol Weight 344.17 g/mol
Molecular Formula C11H14BrN5O3
Exact Mass 343.028002 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LZXvsypySal
Name 8-BrOMOARISTEROMYCIN
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14BrN5O3
InChI InChI=1S/C11H14BrN5O3/c12-11-16-6-9(13)14-3-15-10(6)17(11)5-1-4(2-18)7(19)8(5)20/h3-5,7-8,18-20H,1-2H2,(H2,13,14,15)/t4-,5-,7-,8+/m0/s1
InChIKey WMTPWABIISCXPZ-BKMCOVHNSA-N
Literature Reference Author J.HANRAHAN,H.NAVRATILOVA,K.A.SHOBERU,D.H.G.CROUT,D.W.HUTCHIN SON,S.M.ROBERTS,E.H.
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3533(1994)
Literature Reference DOI 10.1039/p19940003533
Molecular Weight 344.168 g/mol
Solvent DMSO-D6
Source File Reference WANG1342