CID 162396671

(e)-2:2 fluorotelomer unsaturated aldehyde

Structural Information

Molecular Formula
C4H2F4O
SMILES
C(=C(\C(F)(F)F)/F)\C=O
InChI
InChI=1S/C4H2F4O/c5-3(1-2-9)4(6,7)8/h1-2H/b3-1+
InChIKey
HSUJHGMYGPOOSW-HNQUOIGGSA-N
Compound name
(E)-3,4,4,4-tetrafluorobut-2-enal
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

142.00418 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.01146 119.3
[M+Na]+ 164.99340 128.4
[M-H]- 140.99690 114.9
[M+NH4]+ 160.03800 140.8
[M+K]+ 180.96734 127.3
[M+H-H2O]+ 125.00144 112.3
[M+HCOO]- 187.00238 137.6
[M+CH3COO]- 201.01803 172.3
[M+Na-2H]- 162.97885 124.7
[M]+ 142.00363 113.5
[M]- 142.00473 113.5
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

No patent data available for this compound.