CID 65346774

6-bromo-1-ethyl-1h-1,3-benzodiazol-2-amine

Structural Information

Molecular Formula
C9H10BrN3
SMILES
CCN1C2=C(C=CC(=C2)Br)N=C1N
InChI
InChI=1S/C9H10BrN3/c1-2-13-8-5-6(10)3-4-7(8)12-9(13)11/h3-5H,2H2,1H3,(H2,11,12)
InChIKey
ISPNMRVYCBNKHM-UHFFFAOYSA-N
Compound name
6-bromo-1-ethylbenzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.00581 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.01309 147.3
[M+Na]+ 261.99503 151.4
[M+NH4]+ 257.03963 152.3
[M+K]+ 277.96897 152.2
[M-H]- 237.99853 147.9
[M+Na-2H]- 259.98048 150.3
[M]+ 239.00526 146.9
[M]- 239.00636 146.9
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

No patent data available for this compound.