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(5R,11R)-13-(3-Picolyl)-5,11-iminodibenzo[b,f][1,5]-5,6,11,12-tetrahydrodiazocine
SpectraBase Compound ID 5ZfnVIyZx2P
InChI InChI=1S/C20H18N4/c1-3-9-17-15(7-1)19-23-18-10-4-2-8-16(18)20(22-17)24(19)13-14-6-5-11-21-12-14/h1-12,19-20,22-23H,13H2/t19-,20-/m1/s1
InChIKey COLPQKJLPCXDKC-WOJBJXKFSA-N
Mol Weight 314.39 g/mol
Molecular Formula C20H18N4
Exact Mass 314.153147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F59EKwAc06W
Name (5R,11R)-13-(3-Picolyl)-5,11-iminodibenzo[b,f][1,5]-5,6,11,12-tetrahydrodiazocine
Alternate Name(s) (1R,9R)-17-(3-pyridinylmethyl)-8,16,17-triazatetracyclo[7.7.1.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaene 13-(3-Picolyl)-5,11-iminodibenzo[b,f][1,5]-5,6,11,12-tetrahydrodiazocine
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Formula C20H18N4
InChI InChI=1S/C20H18N4/c1-3-9-17-15(7-1)19-23-18-10-4-2-8-16(18)20(22-17)24(19)13-14-6-5-11-21-12-14/h1-12,19-20,22-23H,13H2/t19-,20-/m1/s1
InChIKey COLPQKJLPCXDKC-WOJBJXKFSA-N
Molecular Weight 314.392 g/mol
SMILES N1c2c([C@]3(N([C@@]1(c1ccccc1N3)[H])Cc1cnccc1)[H])cccc2
SPLASH splash10-014m-9500000000-fc9b50cbd2d126cca8bd
Source of Spectrum F-54-1002-2
Wiley ID 805389