CID 136220

1,2-dichlorotetrafluorocyclobutene-1

Structural Information

Molecular Formula
C4Cl2F4
SMILES
C1(=C(C(C1(F)F)(F)F)Cl)Cl
InChI
InChI=1S/C4Cl2F4/c5-1-2(6)4(9,10)3(1,7)8
InChIKey
KAHIKRWJVIBASP-UHFFFAOYSA-N
Compound name
1,2-dichloro-3,3,4,4-tetrafluorocyclobutene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

136
Patents

193.93132 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.93860 115.3
[M+Na]+ 216.92054 129.0
[M-H]- 192.92404 115.1
[M+NH4]+ 211.96514 134.4
[M+K]+ 232.89448 126.2
[M+H-H2O]+ 176.92858 108.3
[M+HCOO]- 238.92952 126.7
[M+CH3COO]- 252.94517 184.8
[M+Na-2H]- 214.90599 122.1
[M]+ 193.93077 122.7
[M]- 193.93187 122.7
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