CID 165942791

2-[5-(2-methoxyethoxy)-1h-1,3-benzodiazol-2-yl]ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C12H17N3O2
SMILES
COCCOC1=CC2=C(C=C1)N=C(N2)CCN
InChI
InChI=1S/C12H17N3O2/c1-16-6-7-17-9-2-3-10-11(8-9)15-12(14-10)4-5-13/h2-3,8H,4-7,13H2,1H3,(H,14,15)
InChIKey
ZJSHDIPMVMPJMC-UHFFFAOYSA-N
Compound name
2-[6-(2-methoxyethoxy)-1H-benzimidazol-2-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.13208 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.13936 152.3
[M+Na]+ 258.12130 163.7
[M+NH4]+ 253.16590 159.2
[M+K]+ 274.09524 159.4
[M-H]- 234.12480 152.9
[M+Na-2H]- 256.10675 157.1
[M]+ 235.13153 153.8
[M]- 235.13263 153.8
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.