| SpectraBase Spectrum ID |
dhVc2HrRE5 |
| Name |
1-(3,5-Bis(trifluoromethyl)benzyl)-1,4-diazabicyclo[2.2.2]octan-1-ium chlorid |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.098445233 u |
| Formula |
C15H17ClF6N2 |
| InChI |
InChI=1S/C15H17F6N2.ClH/c16-14(17,18)12-7-11(8-13(9-12)15(19,20)21)10-23-4-1-22(2-5-23)3-6-23;/h7-9H,1-6,10H2;1H/q+1;/p-1 |
| InChIKey |
PTBAJJFEDDBZES-UHFFFAOYSA-M |
| Instrument Name |
Finnigan SSQ 7000 or Thermo Deca XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600249 |
| Molecular Weight |
374.758 g/mol |
| SMILES |
[Cl-].C1[N+]2(CCN(C1)CC2)CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
| SPLASH |
splash10-004i-0090000000-92850557c6327f24d790 |
| Source of Spectrum |
QE-22-SM4-10 (DOI: 10.1002/chem.201600249) |
| Wiley ID |
1903255 |
![1-(3,5-Bis(trifluoromethyl)benzyl)-1,4-diazabicyclo[2.2.2]octan-1-ium chlorid](/api/spectrum/dhVc2HrRE5/structure.png?h=300&w=458 "1-(3,5-Bis(trifluoromethyl)benzyl)-1,4-diazabicyclo[2.2.2]octan-1-ium chlorid")
