CID 3017142
59536-15-1
Structural Information
- Molecular Formula
- C15H4ClF17O3S
- SMILES
- C1=CC(=CC=C1OC(=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F)S(=O)(=O)Cl
- InChI
- InChI=1S/C15H4ClF17O3S/c16-37(34,35)6-3-1-5(2-4-6)36-8(18)7(17)9(19,20)10(21,22)11(23,24)12(25,26)13(27,28)14(29,30)15(31,32)33/h1-4H
- InChIKey
- PPJLYJGIFDYVNT-UHFFFAOYSA-N
- Compound name
- 4-(1,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluoronon-1-enoxy)benzenesulfonyl chloride
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 622.93708 | 207.7 |
[M+Na]+ | 644.91902 | 189.4 |
[M-H]- | 620.92252 | 190.7 |
[M+NH4]+ | 639.96362 | 195.6 |
[M+K]+ | 660.89296 | 210.4 |
[M+H-H2O]+ | 604.92706 | 190.9 |
[M+HCOO]- | 666.92800 | 203.0 |
[M+CH3COO]- | 680.94365 | 249.0 |
[M+Na-2H]- | 642.90447 | 208.6 |
[M]+ | 621.92925 | 184.7 |
[M]- | 621.93035 | 184.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.