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3,3':5',3''-bis(trimethylene)-2,2':6',2''-terpyridine
SpectraBase Compound ID B9n8QonQhCO
InChI InChI=1S/C21H19N3/c1-5-14-9-3-11-22-18(14)20-16(7-1)13-17-8-2-6-15-10-4-12-23-19(15)21(17)24-20/h3-4,9-13H,1-2,5-8H2
InChIKey CVGJXDUPYVIJME-UHFFFAOYSA-N
Mol Weight 313.4 g/mol
Molecular Formula C21H19N3
Exact Mass 313.157898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YFwd9iW3QQ
Name 3,3':5',3''-bis(trimethylene)-2,2':6',2''-terpyridine
CAS Registry Number 96413-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3
InChI InChI=1S/C21H19N3/c1-5-14-9-3-11-22-18(14)20-16(7-1)13-17-8-2-6-15-10-4-12-23-19(15)21(17)24-20/h3-4,9-13H,1-2,5-8H2
InChIKey CVGJXDUPYVIJME-UHFFFAOYSA-N
Molecular Weight 313.404 g/mol
SMILES c1-2nc-3c(cc1CCCc1cccnc21)CCCc1cccnc31
SPLASH splash10-03di-0039000000-eb2e07bbb80c2e9a9219
Source of Spectrum J-50-2412-2
Synonyms 3,3',5',3''-bis(Trimethylene)-2,2' : 6',2''-terpyridine 5,6,7,9,10,11-hexahydropyrido[3',2':6,7]cyclohepta[1,2-b]pyrido[2',3':3,4]cyclohepta[1,2-e]pyridine
Wiley ID 1314463