| SpectraBase Compound ID | 6dWaxVvQ6cb |
|---|---|
| InChI | InChI=1S/C26H40N5/c1-19(13-15-26(5)21(3)11-8-12-22(26)4)9-7-10-20(2)14-16-31-18-30(6)25-23(31)24(27)28-17-29-25/h9,11,14,17-18,22H,7-8,10,12-13,15-16H2,1-6H3,(H2,27,28,29)/q+1/b19-9+,20-14+ |
| InChIKey | BMJABLUWVJRIBX-KYRQBFFOSA-N |
| Mol Weight | 422.6 g/mol |
| Molecular Formula | C26H40N5 |
| Exact Mass | 422.328371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6DCo90ZpHvb |
|---|---|
| Name | Ageline A cation |
| CAS Registry Number | 101692-71-1 |
| Comments | CHLORIDE, REASSIGNED A.H. |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C26H40N5 |
| InChI | InChI=1S/C26H40N5/c1-19(13-15-26(5)21(3)11-8-12-22(26)4)9-7-10-20(2)14-16-31-18-30(6)25-23(31)24(27)28-17-29-25/h9,11,14,17-18,22H,7-8,10,12-13,15-16H2,1-6H3,(H2,27,28,29)/q+1/b19-9+,20-14+ |
| InChIKey | BMJABLUWVJRIBX-KYRQBFFOSA-N |
| Literature Reference | R.J. Capon, D.J. Faulkner, J. Am. Chem. Soc. 106, 1819 (1984). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |