![4-(diphenylmethyl)-1-[(octylimino)methyl]piperidine, sulfate(1.1), hemihydrate](/api/spectrum/9OEdkcJAJJx/structure.png?h=300&w=458 "4-(diphenylmethyl)-1-[(octylimino)methyl]piperidine, sulfate(1.1), hemihydrate")
| SpectraBase Compound ID | 8wgVIY3jwa3 |
|---|---|
| InChI | InChI=1S/2C27H38N2.2H2O4S.H2O/c2*1-2-3-4-5-6-13-20-28-23-29-21-18-26(19-22-29)27(24-14-9-7-10-15-24)25-16-11-8-12-17-25;2*1-5(2,3)4;/h2*7-12,14-17,23,26-27H,2-6,13,18-22H2,1H3;2*(H2,1,2,3,4);1H2/b2*28-23+;;; |
| InChIKey | DZLXKTCZFYOEES-FZGZZAAPSA-N |
| Mol Weight | 497.69 g/mol |
| Molecular Formula | C27H40N2O4S·½H2O |
| Exact Mass | 497.276161 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9OEdkcJAJJx |
|---|---|
| Name | 4-(diphenylmethyl)-1-[(octylimino)methyl]piperidine, sulfate(1.1), hemihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H42N2O5S |
| InChI | InChI=1S/2C27H38N2.2H2O4S.H2O/c2*1-2-3-4-5-6-13-20-28-23-29-21-18-26(19-22-29)27(24-14-9-7-10-15-24)25-16-11-8-12-17-25;2*1-5(2,3)4;/h2*7-12,14-17,23,26-27H,2-6,13,18-22H2,1H3;2*(H2,1,2,3,4);1H2/b2*28-23+;;; |
| InChIKey | DZLXKTCZFYOEES-FZGZZAAPSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 45969M |
| Solvent | CDCl3 |