CID 3025413
102613-19-4
Structural Information
- Molecular Formula
- C12H21N3O2
- SMILES
- CCCCN1C(=C(C(=O)N(C1=O)C)N(C)C)C
- InChI
- InChI=1S/C12H21N3O2/c1-6-7-8-15-9(2)10(13(3)4)11(16)14(5)12(15)17/h6-8H2,1-5H3
- InChIKey
- MWLGWFZXQAMCOB-UHFFFAOYSA-N
- Compound name
- 1-butyl-5-(dimethylamino)-3,6-dimethylpyrimidine-2,4-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 240.17066 | 153.2 |
[M+Na]+ | 262.15260 | 163.9 |
[M-H]- | 238.15610 | 156.7 |
[M+NH4]+ | 257.19720 | 169.9 |
[M+K]+ | 278.12654 | 162.1 |
[M+H-H2O]+ | 222.16064 | 145.7 |
[M+HCOO]- | 284.16158 | 176.5 |
[M+CH3COO]- | 298.17723 | 202.6 |
[M+Na-2H]- | 260.13805 | 156.0 |
[M]+ | 239.16283 | 159.2 |
[M]- | 239.16393 | 159.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.