CID 34123
28045-65-0
Structural Information
- Molecular Formula
- C10H11NO2S
- SMILES
- CC(=O)NC1=CC=CC=C1OC(=S)C
- InChI
- InChI=1S/C10H11NO2S/c1-7(12)11-9-5-3-4-6-10(9)13-8(2)14/h3-6H,1-2H3,(H,11,12)
- InChIKey
- OFYPTJKINUWOPA-UHFFFAOYSA-N
- Compound name
- O-(2-acetamidophenyl) ethanethioate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 210.05834 | 144.3 |
[M+Na]+ | 232.04028 | 151.5 |
[M-H]- | 208.04378 | 148.3 |
[M+NH4]+ | 227.08488 | 163.5 |
[M+K]+ | 248.01422 | 148.9 |
[M+H-H2O]+ | 192.04832 | 138.2 |
[M+HCOO]- | 254.04926 | 162.9 |
[M+CH3COO]- | 268.06491 | 186.7 |
[M+Na-2H]- | 230.02573 | 146.1 |
[M]+ | 209.05051 | 146.4 |
[M]- | 209.05161 | 146.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.