CID 510904

2,6-dichloro-3-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine

Structural Information

Molecular Formula
C10H10Cl2N2S
SMILES
CCSCC1=C(N=C2N1C=C(C=C2)Cl)Cl
InChI
InChI=1S/C10H10Cl2N2S/c1-2-15-6-8-10(12)13-9-4-3-7(11)5-14(8)9/h3-5H,2,6H2,1H3
InChIKey
ZBGASZYMMADZJU-UHFFFAOYSA-N
Compound name
2,6-dichloro-3-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

259.99417 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.00145 151.3
[M+Na]+ 282.98339 164.8
[M-H]- 258.98689 153.7
[M+NH4]+ 278.02799 171.2
[M+K]+ 298.95733 158.3
[M+H-H2O]+ 242.99143 146.1
[M+HCOO]- 304.99237 160.0
[M+CH3COO]- 319.00802 164.5
[M+Na-2H]- 280.96884 153.6
[M]+ 259.99362 159.5
[M]- 259.99472 159.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.