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LISSOClIN_C
SpectraBase Compound ID 8T4d5SvIWeX
InChI InChI=1S/C15H15BrN4/c16-9-1-2-11-12-3-4-18-14(6-10-7-17-8-19-10)15(12)20-13(11)5-9/h1-2,5,7-8,14,18,20H,3-4,6H2,(H,17,19)
InChIKey YEMKOGHBIUALJS-UHFFFAOYSA-N
Mol Weight 331.22 g/mol
Molecular Formula C15H15BrN4
Exact Mass 330.048009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6gHn59nDJEW
Name LISSOClIN_C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H15BrN4
InChI InChI=1S/C15H15BrN4/c16-9-1-2-11-12-3-4-18-14(6-10-7-17-8-19-10)15(12)20-13(11)5-9/h1-2,5,7-8,14,18,20H,3-4,6H2,(H,17,19)
InChIKey YEMKOGHBIUALJS-UHFFFAOYSA-N
Literature Reference Author P.A.SEARLE,T.F.MOLINSKI
Literature Reference Citation J.ORG.CHEM.,59,6600(1994)
Literature Reference DOI 10.1021/jo00101a018
Molecular Weight 331.215 g/mol
Solvent CD3OD
Source File Reference UWMZ2753