CID 16636976

2-[1-(2-methoxyethyl)-1h-1,3-benzodiazol-2-yl]ethan-1-amine

Structural Information

Molecular Formula
C12H17N3O
SMILES
COCCN1C2=CC=CC=C2N=C1CCN
InChI
InChI=1S/C12H17N3O/c1-16-9-8-15-11-5-3-2-4-10(11)14-12(15)6-7-13/h2-5H,6-9,13H2,1H3
InChIKey
KQHXLWPAALNTRT-UHFFFAOYSA-N
Compound name
2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.13716 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.14444 148.7
[M+Na]+ 242.12638 161.2
[M+NH4]+ 237.17098 156.6
[M+K]+ 258.10032 156.0
[M-H]- 218.12988 150.4
[M+Na-2H]- 240.11183 154.6
[M]+ 219.13661 150.8
[M]- 219.13771 150.8
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.