CID 4091808
N-(2,3-xylyl)cyanothioformamide
Structural Information
- Molecular Formula
- C10H10N2S
- SMILES
- CC1=C(C(=CC=C1)NC(=S)C#N)C
- InChI
- InChI=1S/C10H10N2S/c1-7-4-3-5-9(8(7)2)12-10(13)6-11/h3-5H,1-2H3,(H,12,13)
- InChIKey
- SCZTXWNFTJWCSA-UHFFFAOYSA-N
- Compound name
- 1-cyano-N-(2,3-dimethylphenyl)methanethioamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 191.06375 | 138.7 |
[M+Na]+ | 213.04569 | 150.1 |
[M+NH4]+ | 208.09029 | 144.2 |
[M+K]+ | 229.01963 | 139.2 |
[M-H]- | 189.04919 | 134.5 |
[M+Na-2H]- | 211.03114 | 142.6 |
[M]+ | 190.05592 | 138.7 |
[M]- | 190.05702 | 138.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.