CID 136278591
6-(aminomethyl)-2-(1,3-thiazol-4-yl)-3,4-dihydropyrimidin-4-one dihydrochloride
Structural Information
- Molecular Formula
- C8H8N4OS
- SMILES
- C1=C(N=C(NC1=O)C2=CSC=N2)CN
- InChI
- InChI=1S/C8H8N4OS/c9-2-5-1-7(13)12-8(11-5)6-3-14-4-10-6/h1,3-4H,2,9H2,(H,11,12,13)
- InChIKey
- JANUWBKQSGVBCI-UHFFFAOYSA-N
- Compound name
- 4-(aminomethyl)-2-(1,3-thiazol-4-yl)-1H-pyrimidin-6-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 209.04917 | 141.9 |
[M+Na]+ | 231.03111 | 153.9 |
[M+NH4]+ | 226.07571 | 149.1 |
[M+K]+ | 247.00505 | 148.4 |
[M-H]- | 207.03461 | 143.8 |
[M+Na-2H]- | 229.01656 | 148.5 |
[M]+ | 208.04134 | 144.3 |
[M]- | 208.04244 | 144.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.