CID 767321

6-chloro-3-(7-methylimidazo[1,2-a]pyridin-2-yl)-2h-chromen-2-one

Structural Information

Molecular Formula
C17H11ClN2O2
SMILES
CC1=CC2=NC(=CN2C=C1)C3=CC4=C(C=CC(=C4)Cl)OC3=O
InChI
InChI=1S/C17H11ClN2O2/c1-10-4-5-20-9-14(19-16(20)6-10)13-8-11-7-12(18)2-3-15(11)22-17(13)21/h2-9H,1H3
InChIKey
LPFBFMVGBJHVHG-UHFFFAOYSA-N
Compound name
6-chloro-3-(7-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.0509 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.05818 169.3
[M+Na]+ 333.04012 183.9
[M-H]- 309.04362 177.3
[M+NH4]+ 328.08472 185.3
[M+K]+ 349.01406 177.7
[M+H-H2O]+ 293.04816 160.9
[M+HCOO]- 355.04910 186.4
[M+CH3COO]- 369.06475 182.7
[M+Na-2H]- 331.02557 175.7
[M]+ 310.05035 176.9
[M]- 310.05145 176.9
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.