CID 11159387

21381-61-3

Structural Information

Molecular Formula
C8H9N3
SMILES
C1CN=C(N1)C2=CC=NC=C2
InChI
InChI=1S/C8H9N3/c1-3-9-4-2-7(1)8-10-5-6-11-8/h1-4H,5-6H2,(H,10,11)
InChIKey
MWJNDHSPXOXMIH-UHFFFAOYSA-N
Compound name
4-(4,5-dihydro-1H-imidazol-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

13
Patents

147.07965 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.08693 129.2
[M+Na]+ 170.06887 137.0
[M-H]- 146.07237 130.3
[M+NH4]+ 165.11347 147.1
[M+K]+ 186.04281 133.7
[M+H-H2O]+ 130.07691 120.6
[M+HCOO]- 192.07785 149.4
[M+CH3COO]- 206.09350 141.8
[M+Na-2H]- 168.05432 136.3
[M]+ 147.07910 125.2
[M]- 147.08020 125.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe