CID 2758846
Ethyl 3-fluoro-4-methylbenzoylformate
Structural Information
- Molecular Formula
- C11H11FO3
- SMILES
- CCOC(=O)C(=O)C1=CC(=C(C=C1)C)F
- InChI
- InChI=1S/C11H11FO3/c1-3-15-11(14)10(13)8-5-4-7(2)9(12)6-8/h4-6H,3H2,1-2H3
- InChIKey
- VUTUZFBEEDJHDS-UHFFFAOYSA-N
- Compound name
- ethyl 2-(3-fluoro-4-methylphenyl)-2-oxoacetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 211.07651 | 141.5 |
[M+Na]+ | 233.05845 | 150.0 |
[M-H]- | 209.06195 | 144.3 |
[M+NH4]+ | 228.10305 | 160.6 |
[M+K]+ | 249.03239 | 148.6 |
[M+H-H2O]+ | 193.06649 | 134.9 |
[M+HCOO]- | 255.06743 | 163.5 |
[M+CH3COO]- | 269.08308 | 187.7 |
[M+Na-2H]- | 231.04390 | 144.3 |
[M]+ | 210.06868 | 143.4 |
[M]- | 210.06978 | 143.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.