CID 11768573

97168-13-3

Structural Information

Molecular Formula
C4H5F3O
SMILES
C(CO)C(=C(F)F)F
InChI
InChI=1S/C4H5F3O/c5-3(1-2-8)4(6)7/h8H,1-2H2
InChIKey
PCYKQGRAPGQQCB-UHFFFAOYSA-N
Compound name
3,4,4-trifluorobut-3-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

126.02925 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.03653 128.4
[M+Na]+ 149.01847 135.3
[M+NH4]+ 144.06307 133.6
[M+K]+ 164.99241 131.3
[M-H]- 125.02197 122.9
[M+Na-2H]- 147.00392 129.5
[M]+ 126.02870 127.2
[M]- 126.02980 127.2
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