CID 24703389

1-amino-n-(4-bromophenyl)cyclohexane-1-carboxamide

Structural Information

Molecular Formula
C13H17BrN2O
SMILES
C1CCC(CC1)(C(=O)NC2=CC=C(C=C2)Br)N
InChI
InChI=1S/C13H17BrN2O/c14-10-4-6-11(7-5-10)16-12(17)13(15)8-2-1-3-9-13/h4-7H,1-3,8-9,15H2,(H,16,17)
InChIKey
YQJRKIOZFZGTHQ-UHFFFAOYSA-N
Compound name
1-amino-N-(4-bromophenyl)cyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

296.05243 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.05971 160.9
[M+Na]+ 319.04165 161.7
[M+NH4]+ 314.08625 166.7
[M+K]+ 335.01559 159.9
[M-H]- 295.04515 163.7
[M+Na-2H]- 317.02710 165.6
[M]+ 296.05188 160.6
[M]- 296.05298 160.6
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