CID 101429
1h-purin-6-amine, n-dodecyl-
Structural Information
- Molecular Formula
- C17H29N5
- SMILES
- CCCCCCCCCCCCNC1=NC=NC2=C1NC=N2
- InChI
- InChI=1S/C17H29N5/c1-2-3-4-5-6-7-8-9-10-11-12-18-16-15-17(20-13-19-15)22-14-21-16/h13-14H,2-12H2,1H3,(H2,18,19,20,21,22)
- InChIKey
- SBEOUENSMWBHFN-UHFFFAOYSA-N
- Compound name
- N-dodecyl-7H-purin-6-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 304.24958 | 175.6 |
[M+Na]+ | 326.23152 | 181.5 |
[M-H]- | 302.23502 | 172.3 |
[M+NH4]+ | 321.27612 | 187.2 |
[M+K]+ | 342.20546 | 175.3 |
[M+H-H2O]+ | 286.23956 | 165.0 |
[M+HCOO]- | 348.24050 | 193.7 |
[M+CH3COO]- | 362.25615 | 206.8 |
[M+Na-2H]- | 324.21697 | 180.4 |
[M]+ | 303.24175 | 179.1 |
[M]- | 303.24285 | 179.1 |
Literature stripe
No literature data available for this compound.