CID 21923864

1h,1h-undecafluorohexylamine

Structural Information

Molecular Formula

C₆H₄F₁₁N

SMILES

C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)N

InChI

InChI=1S/C6H4F11N/c7-2(8,1-18)3(9,10)4(11,12)5(13,14)6(15,16)17/h1,18H2

InChIKey

FDIHRNYGDZQEAV-UHFFFAOYSA-N

Compound name

2,2,3,3,4,4,5,5,6,6,6-undecafluorohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 109
Patents: 299.0168 Da
Monoisotopic Mass: 3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	300.02408	152.4
[M+Na]+	322.00602	161.2
[M-H]-	298.00952	139.7
[M+NH4]+	317.05062	166.1
[M+K]+	337.97996	158.4
[M+H-H2O]+	282.01406	140.3
[M+HCOO]-	344.01500	156.9
[M+CH3COO]-	358.03065	205.5
[M+Na-2H]-	319.99147	156.0
[M]+	299.01625	133.5
[M]-	299.01735	133.5

Literature stripe

literature stripe

Patent stripe

patents stripe