| SpectraBase Compound ID | EpZel2CcKrF |
|---|---|
| InChI | InChI=1S/C25H34N3.ClHO4/c1-2-10-21(11-3-1)18-23-24(27-14-6-7-15-27)19-22(26-12-4-5-13-26)20-25(23)28-16-8-9-17-28;2-1(3,4)5/h1-3,10-11,19-20,23H,4-9,12-18H2;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey | CXOREMJKZMAENZ-UHFFFAOYSA-M |
| Mol Weight | 476.0 g/mol |
| Molecular Formula | C25H34ClN3O4 |
| Exact Mass | 475.223784 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KLspxzoNFLl |
|---|---|
| Name | 2-benzyl-1,3,5-tri-1-pyrrolidinylcyclohexadienylium perchloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H34ClN3O4 |
| InChI | InChI=1S/C25H34N3.ClHO4/c1-2-10-21(11-3-1)18-23-24(27-14-6-7-15-27)19-22(26-12-4-5-13-26)20-25(23)28-16-8-9-17-28;2-1(3,4)5/h1-3,10-11,19-20,23H,4-9,12-18H2;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey | CXOREMJKZMAENZ-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 28518M |
| Solvent | CDCl3 |