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]+ 143.011456 119.3
[M+Na]+ 164.993398 128.4
[M-H]- 140.996904 114.9
[M+NH4]+ 160.038003 140.8
[M+K]+ 180.967338 127.3
[M+H-H2O]+ 125.001440 112.3
[M+HCOO]- 187.002381 137.6
[M+CH3COO]- 201.018031 172.3
[M+Na-2H]- 162.978846 124.7
[M]+ 142.00363142 113.5
[M]- 142.00472858 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.