CID 119030848
5-cyano-6-methylpyridine-3-sulfonyl chloride
Structural Information
- Molecular Formula
- C7H5ClN2O2S
- SMILES
- CC1=C(C=C(C=N1)S(=O)(=O)Cl)C#N
- InChI
- InChI=1S/C7H5ClN2O2S/c1-5-6(3-9)2-7(4-10-5)13(8,11)12/h2,4H,1H3
- InChIKey
- GOTJWEAPYXTIRB-UHFFFAOYSA-N
- Compound name
- 5-cyano-6-methylpyridine-3-sulfonyl chloride
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 216.98331 | 146.6 |
[M+Na]+ | 238.96525 | 159.7 |
[M-H]- | 214.96875 | 150.2 |
[M+NH4]+ | 234.00985 | 163.9 |
[M+K]+ | 254.93919 | 155.8 |
[M+H-H2O]+ | 198.97329 | 135.3 |
[M+HCOO]- | 260.97423 | 157.0 |
[M+CH3COO]- | 274.98988 | 193.9 |
[M+Na-2H]- | 236.95070 | 150.6 |
[M]+ | 215.97548 | 146.2 |
[M]- | 215.97658 | 146.2 |
Literature stripe
No literature data available for this compound.