CID 9839075

258273-50-6

Structural Information

Molecular Formula
C18H18N2O2
SMILES
CC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CC(=O)OC
InChI
InChI=1S/C18H18N2O2/c1-12-4-7-14(8-5-12)18-15(10-17(21)22-3)20-11-13(2)6-9-16(20)19-18/h4-9,11H,10H2,1-3H3
InChIKey
UVFOVSRWICIMNX-UHFFFAOYSA-N
Compound name
methyl 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

294.13684 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.144116 169.3
[M+Na]+ 317.126058 180.1
[M-H]- 293.129564 175.5
[M+NH4]+ 312.170663 185.4
[M+K]+ 333.099998 175.2
[M+H-H2O]+ 277.134100 160.6
[M+HCOO]- 339.135041 191.3
[M+CH3COO]- 353.150691 204.6
[M+Na-2H]- 315.111506 172.4
[M]+ 294.13629142 174.8
[M]- 294.13738858 174.8
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

patents stripe