CID 13363920

2-(bromomethyl)piperidine hydrobromide

Structural Information

Molecular Formula
C6H12BrN
SMILES
C1CCNC(C1)CBr
InChI
InChI=1S/C6H12BrN/c7-5-6-3-1-2-4-8-6/h6,8H,1-5H2
InChIKey
LFOBJMXNLNZPKU-UHFFFAOYSA-N
Compound name
2-(bromomethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

177.0153 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.022576 132.8
[M+Na]+ 200.004518 141.3
[M-H]- 176.008024 135.5
[M+NH4]+ 195.049123 154.2
[M+K]+ 215.978458 130.8
[M+H-H2O]+ 160.012560 133.1
[M+HCOO]- 222.013501 149.0
[M+CH3COO]- 236.029151 174.6
[M+Na-2H]- 197.989966 140.1
[M]+ 177.01475142 144.9
[M]- 177.01584858 144.9
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