CID 11020629

1,1-bis(bromomethyl)cyclopropane

Structural Information

Molecular Formula
C5H8Br2
SMILES
C1CC1(CBr)CBr
InChI
InChI=1S/C5H8Br2/c6-3-5(4-7)1-2-5/h1-4H2
InChIKey
GJCHFNVRRQTXHL-UHFFFAOYSA-N
Compound name
1,1-bis(bromomethyl)cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

137
Patents

225.89928 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.90656 131.9
[M+Na]+ 248.88850 145.0
[M-H]- 224.89200 139.9
[M+NH4]+ 243.93310 151.3
[M+K]+ 264.86244 130.3
[M+H-H2O]+ 208.89654 140.6
[M+HCOO]- 270.89748 148.6
[M+CH3COO]- 284.91313 196.0
[M+Na-2H]- 246.87395 141.2
[M]+ 225.89873 166.3
[M]- 225.89983 166.3
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