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N,N'-(6,6'-(1H-pyrazole-3,5-diyl)bis(pyridine-6,2-diyl))bis(methylene)bis(1-(pyridin-2-yl)-N-(pyridin-2-ylmethyl)methanamine)

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N,N'-(6,6'-(1H-pyrazole-3,5-diyl)bis(pyridine-6,2-diyl))bis(methylene)bis(1-(pyridin-2-yl)-N-(pyridin-2-ylmethyl)methanamine)
SpectraBase Compound ID DuNbjJ26rwi
InChI InChI=1S/C39H36N10/c1-5-19-40-30(11-1)24-48(25-31-12-2-6-20-41-31)28-34-15-9-17-36(44-34)38-23-39(47-46-38)37-18-10-16-35(45-37)29-49(26-32-13-3-7-21-42-32)27-33-14-4-8-22-43-33/h1-23H,24-29H2,(H,46,47)
InChIKey YKBXQCBRKRIKCI-UHFFFAOYSA-N
Mol Weight 644.8 g/mol
Molecular Formula C39H36N10
Exact Mass 644.312441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NgPz6UbzHy
Name N,N'-(6,6'-(1H-pyrazole-3,5-diyl)bis(pyridine-6,2-diyl))bis(methylene)bis(1-(pyridin-2-yl)-N-(pyridin-2-ylmethyl)methanamine)
Alternate Name(s) 1,1'-((1H-pyrazole-3,5-diyl)bis(pyridine-6,2-diyl))bis(N,N-bis(pyridin-2-ylmethyl)methanamine)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H36N10
InChI InChI=1S/C39H36N10/c1-5-19-40-30(11-1)24-48(25-31-12-2-6-20-41-31)28-34-15-9-17-36(44-34)38-23-39(47-46-38)37-18-10-16-35(45-37)29-49(26-32-13-3-7-21-42-32)27-33-14-4-8-22-43-33/h1-23H,24-29H2,(H,46,47)
InChIKey YKBXQCBRKRIKCI-UHFFFAOYSA-N
Molecular Weight 644.787 g/mol
SMILES [nH]1nc(cc1-c1cccc(n1)CN(Cc1ncccc1)Cc1ncccc1)-c1cccc(n1)CN(Cc1ncccc1)Cc1ccccn1
SPLASH splash10-0k92-0004940000-a9cc9dd90723e3bbbf54
Source of Spectrum U2-2015-4352-4352_1
Wiley ID 1794756