| SpectraBase Compound ID | 43bIbKTrUKh |
|---|---|
| InChI | InChI=1S/C30H18N6/c1-7-31-25-13-19(1)20-2-8-32-26(14-20)28-16-22(4-10-34-28)24-6-12-36-30(18-24)29-17-23(5-11-35-29)21-3-9-33-27(25)15-21/h1-18H |
| InChIKey | DTKLKKVMIVASSI-UHFFFAOYSA-N |
| Mol Weight | 462.52 g/mol |
| Molecular Formula | C30H18N6 |
| Exact Mass | 462.159295 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8kMFkf2lxSE |
|---|---|
| Name | Cyclo-2,2':4,4":2",2"':4"',4"":2"",2""':4""'-4"""-sexipyridine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H18N6 |
| InChI | InChI=1S/C30H18N6/c1-7-31-25-13-19(1)20-2-8-32-26(14-20)28-16-22(4-10-34-28)24-6-12-36-30(18-24)29-17-23(5-11-35-29)21-3-9-33-27(25)15-21/h1-18H |
| InChIKey | DTKLKKVMIVASSI-UHFFFAOYSA-N |
| Molecular Weight | 462.516 g/mol |
| SMILES | c12-c3cc(-c4cc(-c5cc(-c6cc(-c7cc(-c(c2)ccn1)ccn7)ncc6)ccn5)ncc4)ccn3 |
| SPLASH | splash10-0gb9-0090600000-acd6331bd5ea2bcdb19e |
| Source of Spectrum | J-62-2781-2 |
| Synonyms | 3,10,13,20,23,30-hexaazaheptacyclo[25.3.1.1(2,6).1(7,11).1(12,16).1(17,21).1(22,26)]hexatriaconta-1(31),2(36),3,5,7(35),8,10,12(34),13,15,17(33),18,20,22(32),23,25,27,29-octadecaene Cyclo-2,2':4,4'':2'',2''':4''',4'''':2'''',2''''':4'''''-4''''''-sexipyridine |
| Wiley ID | 1391190 |