CID 146082052
2,3,5,6-tetrafluorophenyl 14-hydroxy-3,6,9,12-tetraoxatetradecanoate
Structural Information
- Molecular Formula
- C16H20F4O7
- SMILES
- C1=C(C(=C(C(=C1F)F)OC(=O)COCCOCCOCCOCCO)F)F
- InChI
- InChI=1S/C16H20F4O7/c17-11-9-12(18)15(20)16(14(11)19)27-13(22)10-26-8-7-25-6-5-24-4-3-23-2-1-21/h9,21H,1-8,10H2
- InChIKey
- IAQZNFCJUWXAIR-UHFFFAOYSA-N
- Compound name
- (2,3,5,6-tetrafluorophenyl) 2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 401.12178 | 184.1 |
[M+Na]+ | 423.10372 | 191.1 |
[M-H]- | 399.10722 | 180.6 |
[M+NH4]+ | 418.14832 | 194.6 |
[M+K]+ | 439.07766 | 189.0 |
[M+H-H2O]+ | 383.11176 | 172.8 |
[M+HCOO]- | 445.11270 | 201.0 |
[M+CH3COO]- | 459.12835 | 219.0 |
[M+Na-2H]- | 421.08917 | 182.2 |
[M]+ | 400.11395 | 190.2 |
[M]- | 400.11505 | 190.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.