CID 45496669

1955547-57-5

Structural Information

Molecular Formula
C11H15N3O
SMILES
COCCN1C2=CC=CC=C2N=C1CN
InChI
InChI=1S/C11H15N3O/c1-15-7-6-14-10-5-3-2-4-9(10)13-11(14)8-12/h2-5H,6-8,12H2,1H3
InChIKey
VJDFXHUVLHRDBM-UHFFFAOYSA-N
Compound name
[1-(2-methoxyethyl)benzimidazol-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.1215 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.12878 144.1
[M+Na]+ 228.11072 154.0
[M-H]- 204.11422 146.1
[M+NH4]+ 223.15532 163.3
[M+K]+ 244.08466 150.6
[M+H-H2O]+ 188.11876 136.5
[M+HCOO]- 250.11970 168.2
[M+CH3COO]- 264.13535 188.3
[M+Na-2H]- 226.09617 150.8
[M]+ 205.12095 147.2
[M]- 205.12205 147.2
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.