CID 130830474

1-(2-bromoethyl)-1-methylcyclopropane

Structural Information

Molecular Formula
C6H11Br
SMILES
CC1(CC1)CCBr
InChI
InChI=1S/C6H11Br/c1-6(2-3-6)4-5-7/h2-5H2,1H3
InChIKey
IWXAQJREQAMFSH-UHFFFAOYSA-N
Compound name
1-(2-bromoethyl)-1-methylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

162.00441 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.011686 128.3
[M+Na]+ 184.993628 141.7
[M-H]- 160.997134 136.0
[M+NH4]+ 180.038233 150.0
[M+K]+ 200.967568 132.1
[M+H-H2O]+ 145.001670 129.6
[M+HCOO]- 207.002611 149.9
[M+CH3COO]- 221.018261 179.9
[M+Na-2H]- 182.979076 138.0
[M]+ 162.00386142 148.8
[M]- 162.00495858 148.8
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