CID 13259007

88570-87-0

Structural Information

Molecular Formula
C13H9Cl2N3OS
SMILES
C1=CC2=NC(=C(N2C=C1Cl)CC(=O)N)C3=CC=C(S3)Cl
InChI
InChI=1S/C13H9Cl2N3OS/c14-7-1-4-12-17-13(9-2-3-10(15)20-9)8(5-11(16)19)18(12)6-7/h1-4,6H,5H2,(H2,16,19)
InChIKey
SVBBGLXVJICXTE-UHFFFAOYSA-N
Compound name
2-[6-chloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.98434 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.99162 171.5
[M+Na]+ 347.97356 184.9
[M-H]- 323.97706 177.6
[M+NH4]+ 343.01816 189.7
[M+K]+ 363.94750 177.8
[M+H-H2O]+ 307.98160 165.9
[M+HCOO]- 369.98254 181.4
[M+CH3COO]- 383.99819 183.8
[M+Na-2H]- 345.95901 170.0
[M]+ 324.98379 178.7
[M]- 324.98489 178.7
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.