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

4
Patents

162.99966 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.00694 130.8
[M+Na]+ 185.98888 141.0
[M-H]- 161.99238 134.1
[M+NH4]+ 181.03348 154.6
[M+K]+ 201.96282 130.7
[M+H-H2O]+ 145.99692 131.2
[M+HCOO]- 207.99786 149.5
[M+CH3COO]- 222.01351 171.6
[M+Na-2H]- 183.97433 137.2
[M]+ 162.99911 144.5
[M]- 163.00021 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