CID 3051122

2-(p-tolyl)imidazo(1,2-a)pyridine hydrochloride hemihydrate

Structural Information

Molecular Formula
C14H12N2
SMILES
CC1=CC=C(C=C1)C2=CN3C=CC=CC3=N2
InChI
InChI=1S/C14H12N2/c1-11-5-7-12(8-6-11)13-10-16-9-3-2-4-14(16)15-13/h2-10H,1H3
InChIKey
YKEDVZKOLMCTAQ-UHFFFAOYSA-N
Compound name
2-(4-methylphenyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

73
Patents

208.10005 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.10733 144.7
[M+Na]+ 231.08927 161.9
[M+NH4]+ 226.13387 154.8
[M+K]+ 247.06321 154.6
[M-H]- 207.09277 149.7
[M+Na-2H]- 229.07472 155.5
[M]+ 208.09950 148.8
[M]- 208.10060 148.8
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