CID 2778176

3-bromo-1,1,3,3-tetrafluoropropene

Structural Information

Molecular Formula
C3HBrF4
SMILES
C(=C(F)F)C(F)(F)Br
InChI
InChI=1S/C3HBrF4/c4-3(7,8)1-2(5)6/h1H
InChIKey
FRVWTAHTVVUDFK-UHFFFAOYSA-N
Compound name
3-bromo-1,1,3,3-tetrafluoroprop-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

251
Patents

191.91978 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.92706 130.1
[M+Na]+ 214.90900 142.7
[M-H]- 190.91250 128.8
[M+NH4]+ 209.95360 153.0
[M+K]+ 230.88294 131.9
[M+H-H2O]+ 174.91704 128.6
[M+HCOO]- 236.91798 146.1
[M+CH3COO]- 250.93363 179.8
[M+Na-2H]- 212.89445 136.4
[M]+ 191.91923 141.8
[M]- 191.92033 141.8
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