CID 22002933

1287702-46-8

Structural Information

Molecular Formula

C₁₀H₁₁F₁₁

SMILES

CCCCCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C10H11F11/c1-2-3-4-5-6(11,12)7(13,14)8(15,16)9(17,18)10(19,20)21/h2-5H2,1H3

InChIKey

PYNBFLPZZOMIKE-UHFFFAOYSA-N

Compound name

1,1,1,2,2,3,3,4,4,5,5-undecafluorodecane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 38
Patents: 340.0685 Da
Monoisotopic Mass: 6.4
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]+	341.07578	167.3
[M+Na]+	363.05772	175.5
[M-H]-	339.06122	154.6
[M+NH4]+	358.10232	180.1
[M+K]+	379.03166	172.1
[M+H-H2O]+	323.06576	154.8
[M+HCOO]-	385.06670	170.3
[M+CH3COO]-	399.08235	213.0
[M+Na-2H]-	361.04317	169.7
[M]+	340.06795	151.7
[M]-	340.06905	151.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe