CID 122164553
Isoquinoline-6-sulfonyl fluoride
Structural Information
- Molecular Formula
- C9H6FNO2S
- SMILES
- C1=CC2=C(C=CN=C2)C=C1S(=O)(=O)F
- InChI
- InChI=1S/C9H6FNO2S/c10-14(12,13)9-2-1-8-6-11-4-3-7(8)5-9/h1-6H
- InChIKey
- OPTGZNFRKOIQSE-UHFFFAOYSA-N
- Compound name
- isoquinoline-6-sulfonyl fluoride
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 212.01761 | 140.5 |
[M+Na]+ | 233.99955 | 153.8 |
[M+NH4]+ | 229.04415 | 148.8 |
[M+K]+ | 249.97349 | 145.7 |
[M-H]- | 210.00305 | 140.8 |
[M+Na-2H]- | 231.98500 | 147.3 |
[M]+ | 211.00978 | 143.0 |
[M]- | 211.01088 | 143.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.