CID 23233249

(1z)-1,3,4,4,4-pentafluoro-3-(trifluoromethyl)but-1-ene

Structural Information

Molecular Formula
C5H2F8
SMILES
C(=C\F)\C(C(F)(F)F)(C(F)(F)F)F
InChI
InChI=1S/C5H2F8/c6-2-1-3(7,4(8,9)10)5(11,12)13/h1-2H/b2-1-
InChIKey
SKQJYUPAFGVYKS-UPHRSURJSA-N
Compound name
(Z)-1,3,4,4,4-pentafluoro-3-(trifluoromethyl)but-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

477
Patents

214.00287 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.01015 133.6
[M+Na]+ 236.99209 143.4
[M-H]- 212.99559 124.5
[M+NH4]+ 232.03669 152.0
[M+K]+ 252.96603 140.8
[M+H-H2O]+ 197.00013 123.8
[M+HCOO]- 259.00107 144.7
[M+CH3COO]- 273.01672 186.0
[M+Na-2H]- 234.97754 138.6
[M]+ 214.00232 121.2
[M]- 214.00342 121.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe