CID 81479

1-vinyloxyperfluoropropane

Structural Information

Molecular Formula
C5H3F7O
SMILES
C=COC(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C5H3F7O/c1-2-13-5(11,12)3(6,7)4(8,9)10/h2H,1H2
InChIKey
DAVCAHWKKDIRLY-UHFFFAOYSA-N
Compound name
1-ethenoxy-1,1,2,2,3,3,3-heptafluoropropane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

7497
Patents

212.00722 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.01450 133.5
[M+Na]+ 234.99644 143.0
[M-H]- 210.99994 125.5
[M+NH4]+ 230.04104 151.9
[M+K]+ 250.97038 141.3
[M+H-H2O]+ 195.00448 124.4
[M+HCOO]- 257.00542 145.8
[M+CH3COO]- 271.02107 186.1
[M+Na-2H]- 232.98189 139.2
[M]+ 212.00667 124.1
[M]- 212.00777 124.1
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