CID 2774729
465514-01-6
Structural Information
- Molecular Formula
- C10H9ClN2O2S
- SMILES
- CN1C(=O)C(=C(C=N1)SCC2=CC=CO2)Cl
- InChI
- InChI=1S/C10H9ClN2O2S/c1-13-10(14)9(11)8(5-12-13)16-6-7-3-2-4-15-7/h2-5H,6H2,1H3
- InChIKey
- ROOKICZUZRVMAT-UHFFFAOYSA-N
- Compound name
- 4-chloro-5-(furan-2-ylmethylsulfanyl)-2-methylpyridazin-3-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 257.01460 | 153.3 |
[M+Na]+ | 278.99654 | 168.5 |
[M+NH4]+ | 274.04114 | 161.6 |
[M+K]+ | 294.97048 | 161.2 |
[M-H]- | 255.00004 | 157.4 |
[M+Na-2H]- | 276.98199 | 159.9 |
[M]+ | 256.00677 | 157.4 |
[M]- | 256.00787 | 157.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.