CID 13259010

88570-90-5

Structural Information

Molecular Formula
C14H12ClN3OS
SMILES
CC1=CN2C(=NC(=C2CC(=O)N)C3=CC=C(S3)Cl)C=C1
InChI
InChI=1S/C14H12ClN3OS/c1-8-2-5-13-17-14(10-3-4-11(15)20-10)9(6-12(16)19)18(13)7-8/h2-5,7H,6H2,1H3,(H2,16,19)
InChIKey
YAZXHSNLPWZLJQ-UHFFFAOYSA-N
Compound name
2-[2-(5-chlorothiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.03897 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.04625 168.9
[M+Na]+ 328.02819 181.8
[M-H]- 304.03169 175.6
[M+NH4]+ 323.07279 187.6
[M+K]+ 344.00213 175.4
[M+H-H2O]+ 288.03623 162.8
[M+HCOO]- 350.03717 183.7
[M+CH3COO]- 364.05282 181.8
[M+Na-2H]- 326.01364 167.7
[M]+ 305.03842 175.6
[M]- 305.03952 175.6
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.