CID 819711
6-ethyl-2-mercapto-5-methyl-nicotinonitrile
Structural Information
- Molecular Formula
- C9H10N2S
- SMILES
- CCC1=C(C=C(C(=S)N1)C#N)C
- InChI
- InChI=1S/C9H10N2S/c1-3-8-6(2)4-7(5-10)9(12)11-8/h4H,3H2,1-2H3,(H,11,12)
- InChIKey
- VNPLFOUWJMMDOM-UHFFFAOYSA-N
- Compound name
- 6-ethyl-5-methyl-2-sulfanylidene-1H-pyridine-3-carbonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.06375 | 133.5 |
[M+Na]+ | 201.04569 | 146.2 |
[M+NH4]+ | 196.09029 | 138.7 |
[M+K]+ | 217.01963 | 135.1 |
[M-H]- | 177.04919 | 128.2 |
[M+Na-2H]- | 199.03114 | 137.1 |
[M]+ | 178.05592 | 133.4 |
[M]- | 178.05702 | 133.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.