CID 139597425
Dpflca_5_n, n=1
Structural Information
- Molecular Formula
- C9HF15O2
- SMILES
- C(=C(/C(F)(F)F)\F)(\C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)/F
- InChI
- InChI=1S/C9HF15O2/c10-1(2(11)6(16,17)18)4(12,13)7(19,20)9(23,24)8(21,22)5(14,15)3(25)26/h(H,25,26)/b2-1+
- InChIKey
- VAZOKPJSDFICQA-OWOJBTEDSA-N
- Compound name
- (E)-2,2,3,3,4,4,5,5,6,6,7,8,9,9,9-pentadecafluoronon-7-enoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 426.98098 | 173.1 |
[M+Na]+ | 448.96292 | 163.0 |
[M-H]- | 424.96642 | 162.7 |
[M+NH4]+ | 444.00752 | 165.0 |
[M+K]+ | 464.93686 | 178.4 |
[M+H-H2O]+ | 408.97096 | 159.1 |
[M+HCOO]- | 470.97190 | 169.8 |
[M+CH3COO]- | 484.98755 | 222.7 |
[M+Na-2H]- | 446.94837 | 172.4 |
[M]+ | 425.97315 | 151.8 |
[M]- | 425.97425 | 151.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.