CID 13231828

1-(2-bromophenyl)piperidine

Structural Information

Molecular Formula
C11H14BrN
SMILES
C1CCN(CC1)C2=CC=CC=C2Br
InChI
InChI=1S/C11H14BrN/c12-10-6-2-3-7-11(10)13-8-4-1-5-9-13/h2-3,6-7H,1,4-5,8-9H2
InChIKey
ULDSFDQNVQGLCC-UHFFFAOYSA-N
Compound name
1-(2-bromophenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

239.03096 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.03824 145.6
[M+Na]+ 262.02018 149.9
[M+NH4]+ 257.06478 151.8
[M+K]+ 277.99412 148.2
[M-H]- 238.02368 148.5
[M+Na-2H]- 260.00563 151.1
[M]+ 239.03041 145.9
[M]- 239.03151 145.9
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