CID 10042673

1,2-dichloro-1,2,2-trifluoroethyl heptafluoropropyl ether

Structural Information

Molecular Formula
C5Cl2F10O
SMILES
C(C(OC(C(F)(F)Cl)(F)Cl)(F)F)(C(F)(F)F)(F)F
InChI
InChI=1S/C5Cl2F10O/c6-2(10,11)3(7,12)18-5(16,17)1(8,9)4(13,14)15
InChIKey
RDUGZRZKLLEFFJ-UHFFFAOYSA-N
Compound name
1-(1,2-dichloro-1,2,2-trifluoroethoxy)-1,1,2,2,3,3,3-heptafluoropropane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

6
Patents

335.91666 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.92394 148.4
[M+Na]+ 358.90588 159.5
[M-H]- 334.90938 137.6
[M+NH4]+ 353.95048 162.9
[M+K]+ 374.87982 154.3
[M+H-H2O]+ 318.91392 138.7
[M+HCOO]- 380.91486 145.9
[M+CH3COO]- 394.93051 205.4
[M+Na-2H]- 356.89133 153.8
[M]+ 335.91611 137.5
[M]- 335.91721 137.5
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