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JGLCQIQOSRBJBA-UHFFFAOYSA-J

View entire compound with spectra: 2 NMR

JGLCQIQOSRBJBA-UHFFFAOYSA-J
SpectraBase Compound ID 9uxjPkowp5Q
InChI InChI=1S/2C16H13ClN4O2.Al/c2*1-10-15(19-18-13-9-11(17)7-8-14(13)22)16(23)21(20-10)12-5-3-2-4-6-12;/h2*2-9,22-23H,1H3;/q;;+4/p-4
InChIKey JGLCQIQOSRBJBA-UHFFFAOYSA-J
Mol Weight 680.5 g/mol
Molecular Formula C32H22AlCl2N8O4
Exact Mass 679.095645 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KHsPwGzshG4
Name JGLCQIQOSRBJBA-UHFFFAOYSA-J
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H22AlCl2N8O4
InChI InChI=1S/2C16H13ClN4O2.Al/c2*1-10-15(19-18-13-9-11(17)7-8-14(13)22)16(23)21(20-10)12-5-3-2-4-6-12;/h2*2-9,22-23H,1H3;/q;;+4/p-4
InChIKey JGLCQIQOSRBJBA-UHFFFAOYSA-J
Literature Reference Author A.LYCKA,P.RYS,P.SKRABAL
Literature Reference Citation MAGN.RES.CHEM.,36,279(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199804)36:4<279::aid-omr263>3.0.co;2-7
Molecular Weight 680.465 g/mol
Solvent DMSO-D6