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3,3':5,3''-bis(trimethylene)-2,6-di(1',8'-naphthyrid-2'-yl)pyridine

View entire compound with spectra: 1 MS (GC)

3,3':5,3''-bis(trimethylene)-2,6-di(1',8'-naphthyrid-2'-yl)pyridine
SpectraBase Compound ID LEhTFuswiDa
InChI InChI=1S/C27H21N5/c1-5-16-13-17-6-2-8-19-15-21-10-4-12-29-27(21)32-25(19)23(17)30-22(16)24-18(7-1)14-20-9-3-11-28-26(20)31-24/h3-4,9-15H,1-2,5-8H2
InChIKey MEPBZFBNQSQBLG-UHFFFAOYSA-N
Mol Weight 415.5 g/mol
Molecular Formula C27H21N5
Exact Mass 415.179696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFxqGjlfmay
Name 3,3':5,3''-bis(trimethylene)-2,6-di(1',8'-naphthyrid-2'-yl)pyridine
Alternate Name(s) 3,3':5,3''-bis(trimethylene)-2,6-di(1',8'-naphthyrid-2'-yl)pyridine 7,8,9,11,12,13-hexahydro[1,8]naphthyridino[2''',3''':3'',4'']cyclohepta[1'',2'':5',6']pyrido[3',2':6,7]cyclohepta[1,2-b][1,8]naphthyridine
CAS Registry Number 96413-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H21N5
InChI InChI=1S/C27H21N5/c1-5-16-13-17-6-2-8-19-15-21-10-4-12-29-27(21)32-25(19)23(17)30-22(16)24-18(7-1)14-20-9-3-11-28-26(20)31-24/h3-4,9-15H,1-2,5-8H2
InChIKey MEPBZFBNQSQBLG-UHFFFAOYSA-N
Molecular Weight 415.500 g/mol
SMILES c1-2nc-3c(cc1CCCc1cc4cccnc4nc21)CCCc1cc2cccnc2nc31
SPLASH splash10-014i-0002900000-d6fb29ef037ea952bb0e
Source of Spectrum J-50-2412-14
Wiley ID 1376073