CID 117275421
2,3,5,6-tetrafluoro-4-formylbenzoic acid
Structural Information
- Molecular Formula
- C8H2F4O3
- SMILES
- C(=O)C1=C(C(=C(C(=C1F)F)C(=O)O)F)F
- InChI
- InChI=1S/C8H2F4O3/c9-4-2(1-13)5(10)7(12)3(6(4)11)8(14)15/h1H,(H,14,15)
- InChIKey
- ACBNSMCHGKYMKE-UHFFFAOYSA-N
- Compound name
- 2,3,5,6-tetrafluoro-4-formylbenzoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 223.00128 | 134.0 |
[M+Na]+ | 244.98322 | 146.4 |
[M-H]- | 220.98672 | 132.7 |
[M+NH4]+ | 240.02782 | 152.4 |
[M+K]+ | 260.95716 | 143.0 |
[M+H-H2O]+ | 204.99126 | 125.8 |
[M+HCOO]- | 266.99220 | 153.1 |
[M+CH3COO]- | 281.00785 | 188.1 |
[M+Na-2H]- | 242.96867 | 135.3 |
[M]+ | 221.99345 | 131.1 |
[M]- | 221.99455 | 131.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.