CID 420919

3-bromopiperidine hydrobromide

Structural Information

Molecular Formula
C5H10BrN
SMILES
C1CC(CNC1)Br
InChI
InChI=1S/C5H10BrN/c6-5-2-1-3-7-4-5/h5,7H,1-4H2
InChIKey
KXKQNQADWLIDLS-UHFFFAOYSA-N
Compound name
3-bromopiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

162.99966 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.00694 128.3
[M+Na]+ 185.98888 137.2
[M-H]- 161.99238 131.2
[M+NH4]+ 181.03348 150.2
[M+K]+ 201.96282 126.9
[M+H-H2O]+ 145.99692 128.8
[M+HCOO]- 207.99786 144.8
[M+CH3COO]- 222.01351 171.7
[M+Na-2H]- 183.97433 136.1
[M]+ 162.99911 140.1
[M]- 163.00021 140.1
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