CID 58361980

2,2,3,3-tetrafluoro-1,4-dimethoxybutane

Structural Information

Molecular Formula
C6H10F4O2
SMILES
COCC(C(COC)(F)F)(F)F
InChI
InChI=1S/C6H10F4O2/c1-11-3-5(7,8)6(9,10)4-12-2/h3-4H2,1-2H3
InChIKey
MWFDZQADYQEPQG-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrafluoro-1,4-dimethoxybutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

190.06169 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.06897 134.8
[M+Na]+ 213.05091 143.0
[M-H]- 189.05441 130.1
[M+NH4]+ 208.09551 154.4
[M+K]+ 229.02485 142.8
[M+H-H2O]+ 173.05895 127.5
[M+HCOO]- 235.05989 151.7
[M+CH3COO]- 249.07554 183.2
[M+Na-2H]- 211.03636 141.0
[M]+ 190.06114 132.8
[M]- 190.06224 132.8
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

patents stripe