CID 22284216
2-amino-3-(perfluoropropyl)-1-phenyl-3-propanol
Structural Information
- Molecular Formula
- C12H12F7NO
- SMILES
- C1=CC=C(C=C1)CC(C(C(C(C(F)(F)F)(F)F)(F)F)O)N
- InChI
- InChI=1S/C12H12F7NO/c13-10(14,11(15,16)12(17,18)19)9(21)8(20)6-7-4-2-1-3-5-7/h1-5,8-9,21H,6,20H2
- InChIKey
- OAJRTQKSHFARBK-UHFFFAOYSA-N
- Compound name
- 2-amino-4,4,5,5,6,6,6-heptafluoro-1-phenylhexan-3-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 320.08800 | 163.5 |
[M+Na]+ | 342.06994 | 169.5 |
[M-H]- | 318.07344 | 156.0 |
[M+NH4]+ | 337.11454 | 176.0 |
[M+K]+ | 358.04388 | 165.5 |
[M+H-H2O]+ | 302.07798 | 152.3 |
[M+HCOO]- | 364.07892 | 171.9 |
[M+CH3COO]- | 378.09457 | 206.1 |
[M+Na-2H]- | 340.05539 | 164.7 |
[M]+ | 319.08017 | 150.4 |
[M]- | 319.08127 | 150.4 |
Literature stripe
No literature data available for this compound.