CID 107340

4798-39-4

Structural Information

Molecular Formula
C11H14F6O4
SMILES
C1C(O1)COCC(C(C(COCC2CO2)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H14F6O4/c12-9(13,5-18-1-7-3-20-7)11(16,17)10(14,15)6-19-2-8-4-21-8/h7-8H,1-6H2
InChIKey
OIGSRLUDJHIAPI-UHFFFAOYSA-N
Compound name
2-[[2,2,3,3,4,4-hexafluoro-5-(oxiran-2-ylmethoxy)pentoxy]methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

47
Patents

324.07962 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.08690 156.1
[M+Na]+ 347.06884 162.4
[M-H]- 323.07234 157.2
[M+NH4]+ 342.11344 157.3
[M+K]+ 363.04278 162.6
[M+H-H2O]+ 307.07688 145.2
[M+HCOO]- 369.07782 165.0
[M+CH3COO]- 383.09347 213.8
[M+Na-2H]- 345.05429 161.4
[M]+ 324.07907 158.5
[M]- 324.08017 158.5
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