CID 98453530

Dtxsid50895403

Structural Information

Molecular Formula

C₁₀H₂ClF₁₇

SMILES

C=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)Cl

InChI

InChI=1S/C10H2ClF17/c1-2(11)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)10(26,27)28/h1H2

InChIKey

TXEZRHDYRLWBDY-UHFFFAOYSA-N

Compound name

2-chloro-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-ene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 479.95737 Da
Monoisotopic Mass: 7.1
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]+	480.964646	185.5
[M+Na]+	502.946588	172.7
[M-H]-	478.950094	172.5
[M+NH4]+	497.991193	175.4
[M+K]+	518.920528	190.0
[M+H-H2O]+	462.954630	170.8
[M+HCOO]-	524.955571	184.9
[M+CH3COO]-	538.971221	233.8
[M+Na-2H]-	500.932036	187.1
[M]+	479.95682142	166.5
[M]-	479.95791858	166.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.