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KMRYJQCJYHIOBZ-UHFFFAOYSA-N
SpectraBase Compound ID DQCCY7vagUt
InChI InChI=1S/C8H5BrClN3/c9-6-3-1-5(2-4-6)7-11-8(10)13-12-7/h1-4H,(H,11,12,13)
InChIKey KMRYJQCJYHIOBZ-UHFFFAOYSA-N
Mol Weight 258.51 g/mol
Molecular Formula C8H5BrClN3
Exact Mass 256.935538 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bf4J6BvLG8l
Name KMRYJQCJYHIOBZ-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H5BrClN3
InChI InChI=1S/C8H5BrClN3/c9-6-3-1-5(2-4-6)7-11-8(10)13-12-7/h1-4H,(H,11,12,13)
InChIKey KMRYJQCJYHIOBZ-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 258.505 g/mol
Source File Reference MHKO27155