CID 2776259

1h,1h-perfluorononylamine

Structural Information

Molecular Formula
C9H4F17N
SMILES
C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N
InChI
InChI=1S/C9H4F17N/c10-2(11,1-27)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h1,27H2
InChIKey
IHVFAVFXCUPMEN-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononan-1-amine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

84
Patents

449.00723 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 450.01451 187.1
[M+Na]+ 471.99645 163.2
[M-H]- 447.99995 162.7
[M+NH4]+ 467.04105 162.6
[M+K]+ 487.97039 192.2
[M+H-H2O]+ 432.00449 171.5
[M+HCOO]- 494.00543 175.4
[M+CH3COO]- 508.02108 232.3
[M+Na-2H]- 469.98190 189.0
[M]+ 449.00668 152.7
[M]- 449.00778 152.7
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

patents stripe