CID 54581340
Ldn-193594
Structural Information
- Molecular Formula
- C15H11FN4OS
- SMILES
- C1=CC=C(C(=C1)C(=O)C2=C(N=C(S2)NC3=CN=CC=C3)N)F
- InChI
- InChI=1S/C15H11FN4OS/c16-11-6-2-1-5-10(11)12(21)13-14(17)20-15(22-13)19-9-4-3-7-18-8-9/h1-8H,17H2,(H,19,20)
- InChIKey
- XHJMMMPXTUEBMQ-UHFFFAOYSA-N
- Compound name
- [4-amino-2-(pyridin-3-ylamino)-1,3-thiazol-5-yl]-(2-fluorophenyl)methanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 315.07103 | 167.3 |
[M+Na]+ | 337.05297 | 176.4 |
[M-H]- | 313.05647 | 173.8 |
[M+NH4]+ | 332.09757 | 180.6 |
[M+K]+ | 353.02691 | 169.9 |
[M+H-H2O]+ | 297.06101 | 157.4 |
[M+HCOO]- | 359.06195 | 185.8 |
[M+CH3COO]- | 373.07760 | 178.3 |
[M+Na-2H]- | 335.03842 | 168.5 |
[M]+ | 314.06320 | 166.5 |
[M]- | 314.06430 | 166.5 |
Literature stripe
Patent stripe
No patent data available for this compound.