CID 71331524
4-[(heptadecafluorooctyl)oxy]benzene-1,3-diamine
Structural Information
- Molecular Formula
- C14H7F17N2O
- SMILES
- C1=CC(=C(C=C1N)N)OC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
- InChI
- InChI=1S/C14H7F17N2O/c15-7(16,9(19,20)11(23,24)13(27,28)29)8(17,18)10(21,22)12(25,26)14(30,31)34-6-2-1-4(32)3-5(6)33/h1-3H,32-33H2
- InChIKey
- MNBWQFQWDVQHGA-UHFFFAOYSA-N
- Compound name
- 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctoxy)benzene-1,3-diamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 543.03598 | 208.9 |
[M+Na]+ | 565.01792 | 217.8 |
[M-H]- | 541.02142 | 194.3 |
[M+NH4]+ | 560.06252 | 166.9 |
[M+K]+ | 580.99186 | 213.0 |
[M+H-H2O]+ | 525.02596 | 191.8 |
[M+HCOO]- | 587.02690 | 181.4 |
[M+CH3COO]- | 601.04255 | 248.3 |
[M+Na-2H]- | 563.00337 | 210.1 |
[M]+ | 542.02815 | 181.2 |
[M]- | 542.02925 | 181.2 |
Literature stripe
No literature data available for this compound.