CID 53346633

3-(bromomethyl)pyrrolidine hydrobromide

Structural Information

Molecular Formula
C5H10BrN
SMILES
C1CNCC1CBr
InChI
InChI=1S/C5H10BrN/c6-3-5-1-2-7-4-5/h5,7H,1-4H2
InChIKey
MIDGOAWDOGHLCH-UHFFFAOYSA-N
Compound name
3-(bromomethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

162.99966 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.006936 130.8
[M+Na]+ 185.988878 141.0
[M-H]- 161.992384 134.1
[M+NH4]+ 181.033483 154.6
[M+K]+ 201.962818 130.7
[M+H-H2O]+ 145.996920 131.2
[M+HCOO]- 207.997861 149.5
[M+CH3COO]- 222.013511 171.6
[M+Na-2H]- 183.974326 137.2
[M]+ 162.99911142 144.5
[M]- 163.00020858 144.5
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