CID 9793752

1,3-dioxolan-2-one, 4,4-difluoro-

Structural Information

Molecular Formula
C3H2F2O3
SMILES
C1C(OC(=O)O1)(F)F
InChI
InChI=1S/C3H2F2O3/c4-3(5)1-7-2(6)8-3/h1H2
InChIKey
ZTTYKFSKZIRTDP-UHFFFAOYSA-N
Compound name
4,4-difluoro-1,3-dioxolan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13079
Patents

123.9972 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.004476 112.5
[M+Na]+ 146.986418 122.5
[M-H]- 122.989924 115.4
[M+NH4]+ 142.031023 135.9
[M+K]+ 162.960358 124.8
[M+H-H2O]+ 106.994460 107.8
[M+HCOO]- 168.995401 133.7
[M+CH3COO]- 183.011051 165.5
[M+Na-2H]- 144.971866 121.4
[M]+ 123.99665142 111.3
[M]- 123.99774858 111.3
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