| SpectraBase Compound ID | 8g8Ga2kxzWz |
|---|---|
| InChI | InChI=1S/C15H18BrClN.ClHO4/c16-14-7-5-13(6-8-14)15(17)9-12-18-10-3-1-2-4-11-18;2-1(3,4)5/h5-9,12H,1-4,10-11H2;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey | KBPLKPUMNCRZQC-UHFFFAOYSA-M |
| Mol Weight | 427.12 g/mol |
| Molecular Formula | C15H18BrCl2NO4 |
| Exact Mass | 424.979626 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FPTv6wvMIOs |
|---|---|
| Name | 1-(p-bromo-gamma-chlorocinnamylidene)hexahydro-1H-azepinium perchlorate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H18BrCl2NO4 |
| InChI | InChI=1S/C15H18BrClN.ClHO4/c16-14-7-5-13(6-8-14)15(17)9-12-18-10-3-1-2-4-11-18;2-1(3,4)5/h5-9,12H,1-4,10-11H2;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey | KBPLKPUMNCRZQC-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52349M |
| Solvent | Acetonitrile-d3 |