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AQOHOADMHSBFMS-UHFFFAOYSA-M
SpectraBase Compound ID Knuk43FxQLj
InChI InChI=1S/C23H26N3O.BrH/c24-21-4-3-5-23(16-21)27-18-20-8-6-19(7-9-20)17-25-14-10-22(11-15-25)26-12-1-2-13-26;/h3-11,14-16H,1-2,12-13,17-18,24H2;1H/q+1;/p-1
InChIKey AQOHOADMHSBFMS-UHFFFAOYSA-M
Mol Weight 440.39 g/mol
Molecular Formula C23H26BrN3O
Exact Mass 439.125925 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AKIXVH4vsox
Name AQOHOADMHSBFMS-UHFFFAOYSA-M
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26BrN3O
InChI InChI=1S/C23H26N3O.BrH/c24-21-4-3-5-23(16-21)27-18-20-8-6-19(7-9-20)17-25-14-10-22(11-15-25)26-12-1-2-13-26;/h3-11,14-16H,1-2,12-13,17-18,24H2;1H/q+1;/p-1
InChIKey AQOHOADMHSBFMS-UHFFFAOYSA-M
Literature Reference Author S.SCHIAFFINO-ORTEGA,A.ESPINOSA,M.A.GALLO,L.C.LOPEZ-CARA,A.EN TRENA
Literature Reference Citation MAGN.RES.CHEM.,52,40(2014)
Literature Reference DOI 10.1002/mrc.4025
Molecular Weight 440.383 g/mol
Solvent CD3OD
Source File Reference UWBT15508