CID 3024653
6-chloro-4,7-bis(dimethylamino)-2-piperazino-pteridine
Structural Information
- Molecular Formula
- C14H21ClN8
- SMILES
- CN(C)C1=NC(=NC2=C1N=C(C(=N2)N(C)C)Cl)N3CCNCC3
- InChI
- InChI=1S/C14H21ClN8/c1-21(2)12-9-11(18-13(22(3)4)10(15)17-9)19-14(20-12)23-7-5-16-6-8-23/h16H,5-8H2,1-4H3
- InChIKey
- KBWMIUUWZNOXTB-UHFFFAOYSA-N
- Compound name
- 6-chloro-4-N,4-N,7-N,7-N-tetramethyl-2-piperazin-1-ylpteridine-4,7-diamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 337.16506 | 181.5 |
[M+Na]+ | 359.14700 | 189.0 |
[M-H]- | 335.15050 | 181.8 |
[M+NH4]+ | 354.19160 | 188.7 |
[M+K]+ | 375.12094 | 183.5 |
[M+H-H2O]+ | 319.15504 | 169.2 |
[M+HCOO]- | 381.15598 | 189.8 |
[M+CH3COO]- | 395.17163 | 189.1 |
[M+Na-2H]- | 357.13245 | 185.8 |
[M]+ | 336.15723 | 180.9 |
[M]- | 336.15833 | 180.9 |