CID 74888733
Pyridine, 5-chloro-2-ethynyl-3-methyl-
Structural Information
- Molecular Formula
- C8H6ClN
- SMILES
- CC1=CC(=CN=C1C#C)Cl
- InChI
- InChI=1S/C8H6ClN/c1-3-8-6(2)4-7(9)5-10-8/h1,4-5H,2H3
- InChIKey
- MRVYFCYKUDRLNC-UHFFFAOYSA-N
- Compound name
- 5-chloro-2-ethynyl-3-methylpyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 152.02616 | 125.9 |
[M+Na]+ | 174.00810 | 138.7 |
[M-H]- | 150.01160 | 127.1 |
[M+NH4]+ | 169.05270 | 144.8 |
[M+K]+ | 189.98204 | 133.4 |
[M+H-H2O]+ | 134.01614 | 114.9 |
[M+HCOO]- | 196.01708 | 139.6 |
[M+CH3COO]- | 210.03273 | 184.2 |
[M+Na-2H]- | 171.99355 | 132.0 |
[M]+ | 151.01833 | 122.3 |
[M]- | 151.01943 | 122.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.