Neostigmine
2436
Reference
Neostigmine Structure
Systematic / IUPAC Name: 3-[(Dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium
ID: Reference2436
Other Names:
Eustigmin;
Eustigmine;
Prostigmine;
Vagostigmine;
Neostigminum
; more
Formula: C12H19N2O2 +
Class: Therapeutics/Prescription Drugs Sports Doping Drugs
Spectral Data
Neostigmine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Plus Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 45 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 3/12/2015 3:11:01 PM |
Identificators
| InChI | InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 |
| InChI Key | ALWKGYPQUAPLQC-UHFFFAOYSA-N |
| Canonical SMILES | CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C |
| CAS | 59994 |
| Splash | |
| Other Names |
Eustigmin; Eustigmine; Prostigmine; Vagostigmine; Neostigminum; Neostigmin; m-Trimethylammoniumphenyldimethylcarbamate; 3-Trimethylammoniumphenyl N,N-dimethylcarbamate; (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate; 3-{[(Dimethylamino)carbonyl]oxy}-N,N,N-trimethylanilinium; Benzenaminium, 3-{[(dimethylamino)carbonyl]oxy}-N,N,N-trimethyl- |