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2,8-Bis(3-pyridylmethyl)-13-phenyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine
SpectraBase Compound ID HWpDByQJLxO
InChI InChI=1S/C33H28N4/c1-2-8-28(9-3-1)33-36-22-29-18-24(16-26-6-4-14-34-20-26)10-12-31(29)37(33)23-30-19-25(11-13-32(30)36)17-27-7-5-15-35-21-27/h1-15,18-21,33H,16-17,22-23H2
InChIKey GFEUXWLPPICGAN-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C33H28N4
Exact Mass 480.231397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SZmcTEJpr8
Name 2,8-Bis(3-pyridylmethyl)-13-phenyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine
Alternate Name(s) 17-phenyl-5,13-bis(3-pyridinylmethyl)-1,9-diazatetracyclo[7.7.1.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H28N4
InChI InChI=1S/C33H28N4/c1-2-8-28(9-3-1)33-36-22-29-18-24(16-26-6-4-14-34-20-26)10-12-31(29)37(33)23-30-19-25(11-13-32(30)36)17-27-7-5-15-35-21-27/h1-15,18-21,33H,16-17,22-23H2
InChIKey GFEUXWLPPICGAN-UHFFFAOYSA-N
Molecular Weight 480.615 g/mol
SMILES c12N3Cc4c(N(Cc2cc(cc1)Cc1cnccc1)C3c1ccccc1)ccc(c4)Cc1cnccc1
SPLASH splash10-001i-0020900000-a72341aa5ad23294e2a7
Source of Spectrum E1-36-3205-11
Wiley ID 1574739