CID 122163985

2-(2-bromoethoxy)-1,1-difluorocyclopropane

Structural Information

Molecular Formula
C5H7BrF2O
SMILES
C1C(C1(F)F)OCCBr
InChI
InChI=1S/C5H7BrF2O/c6-1-2-9-4-3-5(4,7)8/h4H,1-3H2
InChIKey
KOGZKWGYNINJSI-UHFFFAOYSA-N
Compound name
2-(2-bromoethoxy)-1,1-difluorocyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

199.96483 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.97211 131.3
[M+Na]+ 222.95405 145.6
[M-H]- 198.95755 136.7
[M+NH4]+ 217.99865 151.5
[M+K]+ 238.92799 135.5
[M+H-H2O]+ 182.96209 130.8
[M+HCOO]- 244.96303 151.3
[M+CH3COO]- 258.97868 184.7
[M+Na-2H]- 220.93950 139.6
[M]+ 199.96428 150.8
[M]- 199.96538 150.8
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