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1,3,4,6-Tetraaza-cyclo(3.3.3)azine
SpectraBase Compound ID HxWc33uJN8A
InChI InChI=1S/C8H5N5/c1-2-6-9-4-11-8-12-5-10-7(3-1)13(6)8/h1-5H
InChIKey QIYNFQCKZJNEJE-UHFFFAOYSA-N
Mol Weight 171.16 g/mol
Molecular Formula C8H5N5
Exact Mass 171.054495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3T4FPSb2gl
Name 1,3,4,6-Tetraaza-cyclo(3.3.3)azine
CAS Registry Number 38713-73-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H5N5
InChI InChI=1S/C8H5N5/c1-2-6-9-4-11-8-12-5-10-7(3-1)13(6)8/h1-5H
InChIKey QIYNFQCKZJNEJE-UHFFFAOYSA-N
Instrument Name Nicolet NT-360
Literature Reference M.A. Rossman, N.J. Leonhard, S.Urano, J. Am. Chem. Soc. 107, 3884 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6