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]+ 206.128776 144.1
[M+Na]+ 228.110718 154.0
[M-H]- 204.114224 146.1
[M+NH4]+ 223.155323 163.3
[M+K]+ 244.084658 150.6
[M+H-H2O]+ 188.118760 136.5
[M+HCOO]- 250.119701 168.2
[M+CH3COO]- 264.135351 188.3
[M+Na-2H]- 226.096166 150.8
[M]+ 205.12095142 147.2
[M]- 205.12204858 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.