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HGWIBJXKRLVWKW-UHFFFAOYSA-M

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HGWIBJXKRLVWKW-UHFFFAOYSA-M
SpectraBase Compound ID JVVUz2W6giU
InChI InChI=1S/C31H34N3O3.BrH/c1-32(2)29-18-20-33(21-19-29)23-27-14-10-25(11-15-27)6-3-4-7-26-12-16-28(17-13-26)24-37-31-9-5-8-30(22-31)34(35)36;/h5,8-22H,3-4,6-7,23-24H2,1-2H3;1H/q+1;/p-1
InChIKey HGWIBJXKRLVWKW-UHFFFAOYSA-M
Mol Weight 576.5 g/mol
Molecular Formula C31H34BrN3O3
Exact Mass 575.178355 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ZUuFmDh5MC
Name HGWIBJXKRLVWKW-UHFFFAOYSA-M
Compound Number 3H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H34BrN3O3
InChI InChI=1S/C31H34N3O3.BrH/c1-32(2)29-18-20-33(21-19-29)23-27-14-10-25(11-15-27)6-3-4-7-26-12-16-28(17-13-26)24-37-31-9-5-8-30(22-31)34(35)36;/h5,8-22H,3-4,6-7,23-24H2,1-2H3;1H/q+1;/p-1
InChIKey HGWIBJXKRLVWKW-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 576.533 g/mol
Solvent CD3OD
Source File Reference UWBT15507