CID 46049
Schembl3210807
Structural Information
- Molecular Formula
- C20H44N
- SMILES
- CCCCCCCCCCCCCCCCC[N+](C)(C)C
- InChI
- InChI=1S/C20H44N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2,3)4/h5-20H2,1-4H3/q+1
- InChIKey
- KENBDIBVUKXMTB-UHFFFAOYSA-N
- Compound name
- heptadecyl(trimethyl)azanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 299.35466 | 184.6 |
[M+Na]+ | 321.33660 | 186.2 |
[M-H]- | 297.34010 | 184.2 |
[M+NH4]+ | 316.38120 | 200.8 |
[M+K]+ | 337.31054 | 177.9 |
[M+H-H2O]+ | 281.34464 | 180.7 |
[M+HCOO]- | 343.34558 | 204.3 |
[M+CH3COO]- | 357.36123 | 211.3 |
[M+Na-2H]- | 319.32205 | 187.9 |
[M]+ | 298.34683 | 190.2 |
[M]- | 298.34793 | 190.2 |
Literature stripe
No literature data available for this compound.