CID 66753
Methanesulfonic acid, 1-((2-methylphenyl)amino)-
Structural Information
- Molecular Formula
- C8H11NO3S
- SMILES
- CC1=CC=CC=C1NCS(=O)(=O)O
- InChI
- InChI=1S/C8H11NO3S/c1-7-4-2-3-5-8(7)9-6-13(10,11)12/h2-5,9H,6H2,1H3,(H,10,11,12)
- InChIKey
- HFFSVWNRHLTGLV-UHFFFAOYSA-N
- Compound name
- (2-methylanilino)methanesulfonic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 202.05324 | 139.7 |
[M+Na]+ | 224.03518 | 147.8 |
[M-H]- | 200.03868 | 142.4 |
[M+NH4]+ | 219.07978 | 158.4 |
[M+K]+ | 240.00912 | 144.6 |
[M+H-H2O]+ | 184.04322 | 134.1 |
[M+HCOO]- | 246.04416 | 158.1 |
[M+CH3COO]- | 260.05981 | 180.4 |
[M+Na-2H]- | 222.02063 | 145.1 |
[M]+ | 201.04541 | 141.4 |
[M]- | 201.04651 | 141.4 |
Literature stripe
No literature data available for this compound.