CID 101834
686-83-9
Structural Information
- Molecular Formula
- C17H36NO2
- SMILES
- CCCCCCCCCCCCC(C(=O)O)[N+](C)(C)C
- InChI
- InChI=1S/C17H35NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16(17(19)20)18(2,3)4/h16H,5-15H2,1-4H3/p+1
- InChIKey
- LVBSECZFJBGOCR-UHFFFAOYSA-O
- Compound name
- 1-carboxytridecyl(trimethyl)azanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 287.28188 | 176.2 |
[M+Na]+ | 309.26382 | 178.3 |
[M-H]- | 285.26732 | 175.1 |
[M+NH4]+ | 304.30842 | 191.8 |
[M+K]+ | 325.23776 | 171.1 |
[M+H-H2O]+ | 269.27186 | 173.0 |
[M+HCOO]- | 331.27280 | 194.2 |
[M+CH3COO]- | 345.28845 | 203.2 |
[M+Na-2H]- | 307.24927 | 178.5 |
[M]+ | 286.27405 | 179.4 |
[M]- | 286.27515 | 179.4 |