CID 169957

37697-64-6

Structural Information

Molecular Formula
C5F8O2
SMILES
C1(=C(OC(O1)(C(F)(F)F)C(F)(F)F)F)F
InChI
InChI=1S/C5F8O2/c6-1-2(7)15-3(14-1,4(8,9)10)5(11,12)13
InChIKey
YSYRISKCBOPJRG-UHFFFAOYSA-N
Compound name
4,5-difluoro-2,2-bis(trifluoromethyl)-1,3-dioxole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

10451
Patents

243.97705 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.98433 134.2
[M+Na]+ 266.96627 146.2
[M-H]- 242.96977 130.1
[M+NH4]+ 262.01087 152.8
[M+K]+ 282.94021 146.3
[M+H-H2O]+ 226.97431 125.3
[M+HCOO]- 288.97525 146.2
[M+CH3COO]- 302.99090 188.4
[M+Na-2H]- 264.95172 140.5
[M]+ 243.97650 125.6
[M]- 243.97760 125.6
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