CID 15563962
(2e)-3-(3-bromopyridin-4-yl)prop-2-enoic acid
Structural Information
- Molecular Formula
- C8H6BrNO2
- SMILES
- C1=CN=CC(=C1/C=C/C(=O)O)Br
- InChI
- InChI=1S/C8H6BrNO2/c9-7-5-10-4-3-6(7)1-2-8(11)12/h1-5H,(H,11,12)/b2-1+
- InChIKey
- MFOGFLTZMUQQDC-OWOJBTEDSA-N
- Compound name
- (E)-3-(3-bromopyridin-4-yl)prop-2-enoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 227.96547 | 138.7 |
[M+Na]+ | 249.94741 | 141.8 |
[M+NH4]+ | 244.99201 | 142.4 |
[M+K]+ | 265.92135 | 142.3 |
[M-H]- | 225.95091 | 137.7 |
[M+Na-2H]- | 247.93286 | 141.7 |
[M]+ | 226.95764 | 137.5 |
[M]- | 226.95874 | 137.5 |
Literature stripe
No literature data available for this compound.