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MAJOR-ISOMER

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MAJOR-ISOMER
SpectraBase Compound ID 2k9wxua1OMY
InChI InChI=1S/C17H17BrN4/c1-12(2)11-19-17(13-7-9-14(18)10-8-13)22-16-6-4-3-5-15(16)20-21-22/h3-10,12H,11H2,1-2H3/b19-17+
InChIKey AOIYHIMMPKRMNA-HTXNQAPBSA-N
Mol Weight 357.26 g/mol
Molecular Formula C17H17BrN4
Exact Mass 356.06366 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ld1VwMBJk3A
Name MINOR-ISOMER
Compound Number 4J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17BrN4
InChI InChI=1S/C17H17BrN4/c1-12(2)11-19-17(13-7-9-14(18)10-8-13)22-16-6-4-3-5-15(16)20-21-22/h3-10,12H,11H2,1-2H3/b19-17+
InChIKey AOIYHIMMPKRMNA-HTXNQAPBSA-N
Literature Reference Author A.R.KATRITZKY,C.V.STEVENS,G.F.ZHANG,J.JIANG,N.DEKIMPE
Literature Reference Citation HETEROCYCLES,40,231(1995)
Literature Reference DOI 10.3987/COM-94-S14
Molecular Weight 357.253 g/mol
Solvent CDCl3
Source File Reference UWCP5968