CID 105441436

(2-bromo-1,1-difluoroethyl)cyclopropane

Structural Information

Molecular Formula
C5H7BrF2
SMILES
C1CC1C(CBr)(F)F
InChI
InChI=1S/C5H7BrF2/c6-3-5(7,8)4-1-2-4/h4H,1-3H2
InChIKey
YKPFIWOSZLNOTH-UHFFFAOYSA-N
Compound name
(2-bromo-1,1-difluoroethyl)cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

183.96992 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.97720 130.4
[M+Na]+ 206.95914 143.7
[M-H]- 182.96264 135.4
[M+NH4]+ 202.00374 149.3
[M+K]+ 222.93308 132.9
[M+H-H2O]+ 166.96718 129.1
[M+HCOO]- 228.96812 149.1
[M+CH3COO]- 242.98377 182.8
[M+Na-2H]- 204.94459 138.7
[M]+ 183.96937 147.2
[M]- 183.97047 147.2
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