CID 2758852
71002-71-6
Structural Information
- Molecular Formula
- C10H11NO4
- SMILES
- CCC1=CC(=C(C(=C1)[N+](=O)[O-])O)C(=O)C
- InChI
- InChI=1S/C10H11NO4/c1-3-7-4-8(6(2)12)10(13)9(5-7)11(14)15/h4-5,13H,3H2,1-2H3
- InChIKey
- HRSNNEAZJXNKEX-UHFFFAOYSA-N
- Compound name
- 1-(5-ethyl-2-hydroxy-3-nitrophenyl)ethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 210.07608 | 142.5 |
[M+Na]+ | 232.05802 | 155.2 |
[M+NH4]+ | 227.10262 | 149.5 |
[M+K]+ | 248.03196 | 153.1 |
[M-H]- | 208.06152 | 144.5 |
[M+Na-2H]- | 230.04347 | 147.2 |
[M]+ | 209.06825 | 144.6 |
[M]- | 209.06935 | 144.6 |
Literature stripe
No literature data available for this compound.