CID 5276768
Schembl13329909
Structural Information
- Molecular Formula
- C17H32N4
- SMILES
- CCCCCCCCNC1=NC(=NC(=C1)CCC)N(C)C
- InChI
- InChI=1S/C17H32N4/c1-5-7-8-9-10-11-13-18-16-14-15(12-6-2)19-17(20-16)21(3)4/h14H,5-13H2,1-4H3,(H,18,19,20)
- InChIKey
- ZPIVHQVFCVZQNW-UHFFFAOYSA-N
- Compound name
- 2-N,2-N-dimethyl-4-N-octyl-6-propylpyrimidine-2,4-diamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 293.26998 | 177.2 |
[M+Na]+ | 315.25192 | 181.5 |
[M-H]- | 291.25542 | 178.4 |
[M+NH4]+ | 310.29652 | 190.6 |
[M+K]+ | 331.22586 | 178.6 |
[M+H-H2O]+ | 275.25996 | 167.5 |
[M+HCOO]- | 337.26090 | 199.0 |
[M+CH3COO]- | 351.27655 | 216.3 |
[M+Na-2H]- | 313.23737 | 179.8 |
[M]+ | 292.26215 | 181.6 |
[M]- | 292.26325 | 181.6 |
Literature stripe
No literature data available for this compound.