CID 6748
Echinopsine
Structural Information
- Molecular Formula
- C10H9NO
- SMILES
- CN1C=CC(=O)C2=CC=CC=C21
- InChI
- InChI=1S/C10H9NO/c1-11-7-6-10(12)8-4-2-3-5-9(8)11/h2-7H,1H3
- InChIKey
- CSJAXRKDCCWCSJ-UHFFFAOYSA-N
- Compound name
- 1-methylquinolin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 160.07570 | 129.8 |
[M+Na]+ | 182.05764 | 145.8 |
[M+NH4]+ | 177.10224 | 139.7 |
[M+K]+ | 198.03158 | 137.9 |
[M-H]- | 158.06114 | 133.0 |
[M+Na-2H]- | 180.04309 | 138.6 |
[M]+ | 159.06787 | 133.1 |
[M]- | 159.06897 | 133.1 |