CID 8263

Octafluorocyclobutane

Structural Information

Molecular Formula

C₄F₈

SMILES

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

InChI

InChI=1S/C4F8/c5-1(6)2(7,8)4(11,12)3(1,9)10

InChIKey

BCCOBQSFUDVTJQ-UHFFFAOYSA-N

Compound name

1,1,2,2,3,3,4,4-octafluorocyclobutane

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 30
References: 25518
Patents: 199.98723 Da
Monoisotopic Mass: 1.6
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]+	200.99451	127.8
[M+Na]+	222.97645	141.0
[M-H]-	198.97995	124.5
[M+NH4]+	218.02105	148.6
[M+K]+	238.95039	140.9
[M+H-H2O]+	182.98449	118.2
[M+HCOO]-	244.98543	142.2
[M+CH3COO]-	259.00108	188.6
[M+Na-2H]-	220.96190	133.5
[M]+	199.98668	126.8
[M]-	199.98778	126.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.