CID 101226766

Dtxsid00896728

Structural Information

Molecular Formula
C20H3F25NP
SMILES
C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)NP(C1=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F
InChI
InChI=1S/C20H3F25NP/c21-2-4(23)8(27)12(9(28)5(2)24)47(13-10(29)6(25)3(22)7(26)11(13)30)46-1-14(31,32)15(33,34)16(35,36)17(37,38)18(39,40)19(41,42)20(43,44)45/h46H,1H2
InChIKey
RPEOQCBWVUKKRF-UHFFFAOYSA-N
Compound name
N-bis(2,3,4,5,6-pentafluorophenyl)phosphanyl-2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

762.9604 Da
Monoisotopic Mass

9.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 763.96768 165.5
[M+Na]+ 785.94962 165.6
[M+NH4]+ 780.99422 165.6
[M+K]+ 801.92356 165.8
[M-H]- 761.95312 165.5
[M+Na-2H]- 783.93507 165.8
[M]+ 762.95985 165.5
[M]- 762.96095 165.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.