CID 3559388
Akos024420395
Structural Information
- Molecular Formula
- C17H36NO2
- SMILES
- CCCC[N+](C)(C)CCCCCCCCCCC(=O)O
- InChI
- InChI=1S/C17H35NO2/c1-4-5-15-18(2,3)16-13-11-9-7-6-8-10-12-14-17(19)20/h4-16H2,1-3H3/p+1
- InChIKey
- DDNIDZZSVNCSNP-UHFFFAOYSA-O
- Compound name
- butyl-(10-carboxydecyl)-dimethylazanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 287.28188 | 176.3 |
[M+Na]+ | 309.26382 | 178.6 |
[M-H]- | 285.26732 | 175.1 |
[M+NH4]+ | 304.30842 | 192.0 |
[M+K]+ | 325.23776 | 170.9 |
[M+H-H2O]+ | 269.27186 | 173.0 |
[M+HCOO]- | 331.27280 | 195.2 |
[M+CH3COO]- | 345.28845 | 202.5 |
[M+Na-2H]- | 307.24927 | 179.8 |
[M]+ | 286.27405 | 180.2 |
[M]- | 286.27515 | 180.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.