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

25852
Patents

199.98723 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.994506 127.8
[M+Na]+ 222.976448 141.0
[M-H]- 198.979954 124.5
[M+NH4]+ 218.021053 148.6
[M+K]+ 238.950388 140.9
[M+H-H2O]+ 182.984490 118.2
[M+HCOO]- 244.985431 142.2
[M+CH3COO]- 259.001081 188.6
[M+Na-2H]- 220.961896 133.5
[M]+ 199.98668142 126.8
[M]- 199.98777858 126.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe