CID 13259029

88571-06-6

Structural Information

Molecular Formula
C16H14ClN3O2
SMILES
CCOC(=O)CC1=C(N=C2N1C=C(C=C2)Cl)C3=CC=CC=N3
InChI
InChI=1S/C16H14ClN3O2/c1-2-22-15(21)9-13-16(12-5-3-4-8-18-12)19-14-7-6-11(17)10-20(13)14/h3-8,10H,2,9H2,1H3
InChIKey
UAWJYOVKHDPWPP-UHFFFAOYSA-N
Compound name
ethyl 2-(6-chloro-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.07745 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.08473 170.1
[M+Na]+ 338.06667 186.5
[M+NH4]+ 333.11127 177.6
[M+K]+ 354.04061 180.1
[M-H]- 314.07017 172.8
[M+Na-2H]- 336.05212 178.3
[M]+ 315.07690 173.6
[M]- 315.07800 173.6
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.