| SpectraBase Compound ID | 8fHI767lLak |
|---|---|
| InChI | InChI=1S/C27H19N3/c1-3-7-22-16(5-1)13-18-9-11-20-15-21-12-10-19-14-17-6-2-4-8-23(17)29-25(19)27(20)30-26(21)24(18)28-22/h1-8,13-15H,9-12H2 |
| InChIKey | YPAXKDPJQVYUIZ-UHFFFAOYSA-N |
| Mol Weight | 385.47 g/mol |
| Molecular Formula | C27H19N3 |
| Exact Mass | 385.157898 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Bo7wKbmxWSi |
|---|---|
| Name | 3,3':5,3''-bis(dimethylene)-2,6-di(2'-quinolyl)pyridine |
| Alternate Name(s) | 3,27,30-triazaheptacyclo[14.14.0.0(2,11).0(4,9).0(14,29).0(19,28).0(21,26)]triaconta-1(16),2,4,6,8,10,14,19,21,23,25,27,29-tridecaene 3,3':5,3''-bis(dimethylene)-2,6-di(2'-quinolyl)pyridine |
| CAS Registry Number | 96413-35-3 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H19N3 |
| InChI | InChI=1S/C27H19N3/c1-3-7-22-16(5-1)13-18-9-11-20-15-21-12-10-19-14-17-6-2-4-8-23(17)29-25(19)27(20)30-26(21)24(18)28-22/h1-8,13-15H,9-12H2 |
| InChIKey | YPAXKDPJQVYUIZ-UHFFFAOYSA-N |
| Molecular Weight | 385.470 g/mol |
| SMILES | c1-2nc-3c(CCc4cc5ccccc5nc24)cc1CCc1cc2ccccc2nc31 |
| SPLASH | splash10-000i-0209000000-378d006f33ba4d76d30b |
| Source of Spectrum | J-50-2412-13 |
| Wiley ID | 1362338 |