CID 5150905
1-[2-(pyridin-4-yl)ethyl]-1h-pyrrole-2-carbaldehyde
Structural Information
- Molecular Formula
- C12H12N2O
- SMILES
- C1=CN(C(=C1)C=O)CCC2=CC=NC=C2
- InChI
- InChI=1S/C12H12N2O/c15-10-12-2-1-8-14(12)9-5-11-3-6-13-7-4-11/h1-4,6-8,10H,5,9H2
- InChIKey
- OMZPRARAOXZCDC-UHFFFAOYSA-N
- Compound name
- 1-(2-pyridin-4-ylethyl)pyrrole-2-carbaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 201.10224 | 142.9 |
[M+Na]+ | 223.08418 | 151.6 |
[M-H]- | 199.08768 | 147.0 |
[M+NH4]+ | 218.12878 | 161.1 |
[M+K]+ | 239.05812 | 148.0 |
[M+H-H2O]+ | 183.09222 | 134.5 |
[M+HCOO]- | 245.09316 | 166.6 |
[M+CH3COO]- | 259.10881 | 183.6 |
[M+Na-2H]- | 221.06963 | 148.7 |
[M]+ | 200.09441 | 144.2 |
[M]- | 200.09551 | 144.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.