CID 90111
Surfactive v 18
Structural Information
- Molecular Formula
- C23H48NO2
- SMILES
- CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)C
- InChI
- InChI=1S/C23H48NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(25)26-22-21-24(2,3)4/h5-22H2,1-4H3/q+1
- InChIKey
- SGFBLYBOTWZDDE-UHFFFAOYSA-N
- Compound name
- trimethyl(2-octadecanoyloxyethyl)azanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 371.37578 | 204.1 |
[M+Na]+ | 393.35772 | 204.5 |
[M-H]- | 369.36122 | 203.2 |
[M+NH4]+ | 388.40232 | 221.0 |
[M+K]+ | 409.33166 | 196.2 |
[M+H-H2O]+ | 353.36576 | 199.4 |
[M+HCOO]- | 415.36670 | 236.0 |
[M+CH3COO]- | 429.38235 | 222.5 |
[M+Na-2H]- | 391.34317 | 204.9 |
[M]+ | 370.36795 | 212.2 |
[M]- | 370.36905 | 212.2 |