CID 2762749
2,2':6',2''-terpyridine-4'-carboxylic acid
Structural Information
- Molecular Formula
- C16H11N3O2
- SMILES
- C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C(=O)O
- InChI
- InChI=1S/C16H11N3O2/c20-16(21)11-9-14(12-5-1-3-7-17-12)19-15(10-11)13-6-2-4-8-18-13/h1-10H,(H,20,21)
- InChIKey
- ZYTWXMBGOUJDHJ-UHFFFAOYSA-N
- Compound name
- 2,6-dipyridin-2-ylpyridine-4-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 278.09238 | 163.1 |
[M+Na]+ | 300.07432 | 171.3 |
[M-H]- | 276.07782 | 167.7 |
[M+NH4]+ | 295.11892 | 173.4 |
[M+K]+ | 316.04826 | 165.5 |
[M+H-H2O]+ | 260.08236 | 152.2 |
[M+HCOO]- | 322.08330 | 181.9 |
[M+CH3COO]- | 336.09895 | 173.6 |
[M+Na-2H]- | 298.05977 | 169.7 |
[M]+ | 277.08455 | 161.9 |
[M]- | 277.08565 | 161.9 |