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HYWUCONOWYBZOA-UHFFFAOYSA-N
SpectraBase Compound ID 4Xdi9dPXqYZ
InChI InChI=1S/C16H11BrN6/c17-11-1-3-12(4-2-11)23-16-13(9-20-23)14(18)21-15(22-16)10-5-7-19-8-6-10/h1-9H,(H2,18,21,22)
InChIKey HYWUCONOWYBZOA-UHFFFAOYSA-N
Mol Weight 367.21 g/mol
Molecular Formula C16H11BrN6
Exact Mass 366.022857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Q7btQS1Yu4
Name HYWUCONOWYBZOA-UHFFFAOYSA-N
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11BrN6
InChI InChI=1S/C16H11BrN6/c17-11-1-3-12(4-2-11)23-16-13(9-20-23)14(18)21-15(22-16)10-5-7-19-8-6-10/h1-9H,(H2,18,21,22)
InChIKey HYWUCONOWYBZOA-UHFFFAOYSA-N
Literature Reference Author L.M.RODRIGUES,A.SIVASUBRAMANIAN,E.M.PINTO,A.M.F.OLIVEIRA-CAM POS,J.A.SEIJAS,M.P.V
Literature Reference Citation MAGN.RES.CHEM.,47,84(2009)
Literature Reference DOI 10.1002/mrc.2329
Molecular Weight 367.208 g/mol
Solvent DMSO-D6
Source File Reference UWLU79365