CID 89976397
2169795-24-6
Structural Information
- Molecular Formula
- C5H6F2O2
- SMILES
- C/C(=C\C(=O)O)/C(F)F
- InChI
- InChI=1S/C5H6F2O2/c1-3(5(6)7)2-4(8)9/h2,5H,1H3,(H,8,9)/b3-2+
- InChIKey
- YNBKDAZJXBTDFV-NSCUHMNNSA-N
- Compound name
- (E)-4,4-difluoro-3-methylbut-2-enoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 137.04086 | 123.4 |
[M+Na]+ | 159.02280 | 130.6 |
[M-H]- | 135.02630 | 119.9 |
[M+NH4]+ | 154.06740 | 144.2 |
[M+K]+ | 174.99674 | 130.0 |
[M+H-H2O]+ | 119.03084 | 117.6 |
[M+HCOO]- | 181.03178 | 141.8 |
[M+CH3COO]- | 195.04743 | 171.0 |
[M+Na-2H]- | 157.00825 | 125.6 |
[M]+ | 136.03303 | 119.3 |
[M]- | 136.03413 | 119.3 |
Literature stripe
No literature data available for this compound.