CID 5709611

26885-71-2

Structural Information

Molecular Formula
C4H5F3O
SMILES
CO/C=C/C(F)(F)F
InChI
InChI=1S/C4H5F3O/c1-8-3-2-4(5,6)7/h2-3H,1H3/b3-2+
InChIKey
BGHDVJGMEWAMPO-NSCUHMNNSA-N
Compound name
(E)-3,3,3-trifluoro-1-methoxyprop-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

126.02925 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.03653 118.4
[M+Na]+ 149.01847 127.5
[M-H]- 125.02197 115.3
[M+NH4]+ 144.06307 140.8
[M+K]+ 164.99241 126.9
[M+H-H2O]+ 109.02651 112.3
[M+HCOO]- 171.02745 138.6
[M+CH3COO]- 185.04310 169.6
[M+Na-2H]- 147.00392 125.6
[M]+ 126.02870 115.3
[M]- 126.02980 115.3
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