CID 123586
2',4'-difluoropropiophenone
Structural Information
- Molecular Formula
- C9H8F2O
- SMILES
- CCC(=O)C1=C(C=C(C=C1)F)F
- InChI
- InChI=1S/C9H8F2O/c1-2-9(12)7-4-3-6(10)5-8(7)11/h3-5H,2H2,1H3
- InChIKey
- UZWOADNMVRRYDE-UHFFFAOYSA-N
- Compound name
- 1-(2,4-difluorophenyl)propan-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 171.06160 | 136.2 |
[M+Na]+ | 193.04354 | 147.9 |
[M+NH4]+ | 188.08814 | 143.6 |
[M+K]+ | 209.01748 | 141.5 |
[M-H]- | 169.04704 | 135.5 |
[M+Na-2H]- | 191.02899 | 141.7 |
[M]+ | 170.05377 | 137.5 |
[M]- | 170.05487 | 137.5 |
Literature stripe
No literature data available for this compound.