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QJBSMQWGTHYJKK-UHFFFAOYSA-L

View entire compound with spectra: 2 NMR

QJBSMQWGTHYJKK-UHFFFAOYSA-L
SpectraBase Compound ID 5k9UUiPxcBJ
InChI InChI=1S/2C18H17N3O2.Zn/c2*1-13-17(12-19-14-8-10-16(23-2)11-9-14)18(22)21(20-13)15-6-4-3-5-7-15;/h2*3-12,22H,1-2H3;/q;;+2/p-2
InChIKey QJBSMQWGTHYJKK-UHFFFAOYSA-L
Mol Weight 678.1 g/mol
Molecular Formula C36H32N6O4Zn
Exact Mass 676.177646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AczO3at3gMU
Name QJBSMQWGTHYJKK-UHFFFAOYSA-L
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H32N6O4Zn
InChI InChI=1S/2C18H17N3O2.Zn/c2*1-13-17(12-19-14-8-10-16(23-2)11-9-14)18(22)21(20-13)15-6-4-3-5-7-15;/h2*3-12,22H,1-2H3;/q;;+2/p-2
InChIKey QJBSMQWGTHYJKK-UHFFFAOYSA-L
Literature Reference Author W.FREYER,R.RADEGLIA
Literature Reference Citation MH.CHEM.,112,105(1981)
Literature Reference DOI 10.1007/BF00906247
Molecular Weight 678.068 g/mol
Solvent CDCl3
Source File Reference UWCS9252