CID 3627600
6-chloro-perfluorohexanoic acid
Structural Information
- Molecular Formula
- C6HClF10O2
- SMILES
- C(=O)(C(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(F)F)O
- InChI
- InChI=1S/C6HClF10O2/c7-6(16,17)5(14,15)4(12,13)3(10,11)2(8,9)1(18)19/h(H,18,19)
- InChIKey
- ZDHGZQAAGQRUQT-UHFFFAOYSA-N
- Compound name
- 6-chloro-2,2,3,3,4,4,5,5,6,6-decafluorohexanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 330.95781 | 149.4 |
[M+Na]+ | 352.93975 | 159.3 |
[M-H]- | 328.94325 | 137.4 |
[M+NH4]+ | 347.98435 | 162.8 |
[M+K]+ | 368.91369 | 155.2 |
[M+H-H2O]+ | 312.94779 | 139.5 |
[M+HCOO]- | 374.94873 | 149.2 |
[M+CH3COO]- | 388.96438 | 203.7 |
[M+Na-2H]- | 350.92520 | 153.8 |
[M]+ | 329.94998 | 135.9 |
[M]- | 329.95108 | 135.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.