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HGDUFSDWVKFEHM-UHFFFAOYSA-M

View entire compound with spectra: 1 NMR

HGDUFSDWVKFEHM-UHFFFAOYSA-M
SpectraBase Compound ID JQ0XWXE7SKw
InChI InChI=1S/C22H24N7.BrH/c23-21-20-22(25-15-24-21)29(16-26-20)14-18-5-3-17(4-6-18)13-27-11-7-19(8-12-27)28-9-1-2-10-28;/h3-8,11-12,15-16H,1-2,9-10,13-14H2,(H2,23,24,25);1H/q+1;/p-1
InChIKey HGDUFSDWVKFEHM-UHFFFAOYSA-M
Mol Weight 466.39 g/mol
Molecular Formula C22H24BrN7
Exact Mass 465.127657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9UuM4cs6IZC
Name HGDUFSDWVKFEHM-UHFFFAOYSA-M
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24BrN7
InChI InChI=1S/C22H24N7.BrH/c23-21-20-22(25-15-24-21)29(16-26-20)14-18-5-3-17(4-6-18)13-27-11-7-19(8-12-27)28-9-1-2-10-28;/h3-8,11-12,15-16H,1-2,9-10,13-14H2,(H2,23,24,25);1H/q+1;/p-1
InChIKey HGDUFSDWVKFEHM-UHFFFAOYSA-M
Literature Reference Author B.RUBIO-RUIZ,A.CONEJO-GARCIA,M.A.GALLO,A.ESPINOSA,A.ENTRENA
Literature Reference Citation MAGN.RES.CHEM.,50,466(2012)
Literature Reference DOI 10.1002/mrc.3817
Molecular Weight 466.383 g/mol
Solvent DMSO-D6
Source File Reference UWBT16071