| SpectraBase Spectrum ID |
5t18UhnTuiu |
| Name |
3-{N-(1,4-Diazabicyclo[2.2.2]octyl}methyl-coumarin chloride |
| Alternate Name(s) |
1-(2-Oxo-2H-chromen-3-ylmethyl)-4-aza-1-azonia-bicyclo[2.2.2]octane; chloride |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19ClN2O2 |
| InChI |
InChI=1S/C16H19N2O2.ClH/c19-16-14(11-13-3-1-2-4-15(13)20-16)12-18-8-5-17(6-9-18)7-10-18;/h1-4,11H,5-10,12H2;1H/q+1;/p-1 |
| InChIKey |
BYKXSBSJKKEGRQ-UHFFFAOYSA-M |
| Molecular Weight |
306.793 g/mol |
| SMILES |
[Cl-].C=1(C(Oc2c(C1)cccc2)=O)C[N+]12CCN(CC2)CC1 |
| SPLASH |
splash10-0a4l-0920000000-932b60cfa975e6cacf6d |
| Source of Spectrum |
SK-23-2812-1 |
| Wiley ID |
866001 |
![3-{N-(1,4-Diazabicyclo[2.2.2]octyl}methyl-coumarin chloride](/api/spectrum/5t18UhnTuiu/structure.png?h=300&w=458 "3-{N-(1,4-Diazabicyclo[2.2.2]octyl}methyl-coumarin chloride")
