CID 43649871

1-[4-(4-bromophenyl)-1h-imidazol-2-yl]ethan-1-amine dihydrochloride

Structural Information

Molecular Formula
C11H12BrN3
SMILES
CC(C1=NC=C(N1)C2=CC=C(C=C2)Br)N
InChI
InChI=1S/C11H12BrN3/c1-7(13)11-14-6-10(15-11)8-2-4-9(12)5-3-8/h2-7H,13H2,1H3,(H,14,15)
InChIKey
BBVLMJNZGIDONQ-UHFFFAOYSA-N
Compound name
1-[5-(4-bromophenyl)-1H-imidazol-2-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

265.02145 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.02873 156.1
[M+Na]+ 288.01067 158.7
[M+NH4]+ 283.05527 160.2
[M+K]+ 303.98461 160.2
[M-H]- 264.01417 157.2
[M+Na-2H]- 285.99612 159.6
[M]+ 265.02090 155.4
[M]- 265.02200 155.4
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