CID 3151737

138078-14-5

Structural Information

Molecular Formula
C10H13N3
SMILES
CN1C2=CC=CC=C2N=C1CCN
InChI
InChI=1S/C10H13N3/c1-13-9-5-3-2-4-8(9)12-10(13)6-7-11/h2-5H,6-7,11H2,1H3
InChIKey
KYWISJFMAVDXJU-UHFFFAOYSA-N
Compound name
2-(1-methylbenzimidazol-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

54
Patents

175.11095 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.11823 136.4
[M+Na]+ 198.10017 147.0
[M-H]- 174.10367 138.7
[M+NH4]+ 193.14477 157.0
[M+K]+ 214.07411 143.3
[M+H-H2O]+ 158.10821 129.3
[M+HCOO]- 220.10915 160.7
[M+CH3COO]- 234.12480 150.4
[M+Na-2H]- 196.08562 143.7
[M]+ 175.11040 137.9
[M]- 175.11150 137.9
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.