CID 136658

Undecafluoropiperidine

Structural Information

Molecular Formula

C₅F₁₁N

SMILES

C1(C(C(N(C(C1(F)F)(F)F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C5F11N/c6-1(7)2(8,9)4(12,13)17(16)5(14,15)3(1,10)11

InChIKey

VCEAGMYKGZNUFL-UHFFFAOYSA-N

Compound name

1,2,2,3,3,4,4,5,5,6,6-undecafluoropiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 262
Patents: 282.9855 Da
Monoisotopic Mass: 3.7
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]+	283.99278	131.7
[M+Na]+	305.97472	147.5
[M-H]-	281.97822	123.5
[M+NH4]+	301.01932	155.7
[M+K]+	321.94866	144.5
[M+H-H2O]+	265.98276	122.0
[M+HCOO]-	327.98370	140.5
[M+CH3COO]-	341.99935	200.6
[M+Na-2H]-	303.96017	136.1
[M]+	282.98495	117.3
[M]-	282.98605	117.3

Literature stripe

literature stripe

Patent stripe

patents stripe